16-benzyl-19-thia-2,4,5,7,9,10,16-heptazapentacyclo[10.7.0.02,6.07,11.013,18]nonadeca-1(12),5,10,13(18)-tetraene-3,8-dithione
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![16-benzyl-19-thia-2,4,5,7,9,10,16-heptazapentacyclo[10.7.0.02,6.07,11.013,18]nonadeca-1(12),5,10,13(18)-tetraene-3,8-dithione structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/41294ec09b6a484ebb71bcbfc1ba59c2.png "16-benzyl-19-thia-2,4,5,7,9,10,16-heptazapentacyclo[10.7.0.02,6.07,11.013,18]nonadeca-1(12),5,10,13(18)-tetraene-3,8-dithione")
16-benzyl-19-thia-2,4,5,7,9,10,16-heptazapentacyclo[10.7.0.02,6.07,11.013,18]nonadeca-1(12),5,10,13(18)-tetraene-3,8-dithione
structure -
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CAS No:
369607-29-4
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Formula:
C18H15N7S3
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Chemical Name:
16-benzyl-19-thia-2,4,5,7,9,10,16-heptazapentacyclo[10.7.0.02,6.07,11.013,18]nonadeca-1(12),5,10,13(18)-tetraene-3,8-dithione
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Synonyms:
C18H15N7S3;ZINC2259060;STL357269;STL509763;AKOS022140177;AKOS037490318;MCULE-6009927196;11-benzyl-10,11,12,13-tetrahydropyrido[4',3':4,5]thieno[3,2-e]bis[1,2,4]triazolo[4,3-a:4',3'-c]pyrimidine-3,7(2H,6H)-dithione;11-benzyl-10,11,12,13-tetrahydropyrido[4',3':4,5]thieno[3,2-e]bis[1,2,4]triazolo[4,3-a:4',3'-c]pyrimidine-3,7-dithiol;369607-29-4
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CAS No:
16-benzyl-19-thia-2,4,5,7,9,10,16-heptazapentacyclo[10.7.0.02,6.07,11.013,18]nonadeca-1(12),5,10,13(18)-tetraene-3,8-dithione Basic Attributes
425.6 g/mol
425.05510703 g/mol
Computed Properties
Molecular Weight:425.6
XLogP3:2.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:425.05510703
Monoisotopic Mass:425.05510703
Topological Polar Surface Area:151
Heavy Atom Count:28
Complexity:777
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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