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4,11-dibenzyl-5-sulfanylidene-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-dien-3-one
4,11-dibenzyl-5-sulfanylidene-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-dien-3-one
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![4,11-dibenzyl-5-sulfanylidene-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-dien-3-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/dfab996d3bba4eb4b52eab622db0e1f1.png "4,11-dibenzyl-5-sulfanylidene-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-dien-3-one")
4,11-dibenzyl-5-sulfanylidene-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-dien-3-one
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CAS No:
371780-86-8
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Formula:
C23H21N3OS2
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Chemical Name:
4,11-dibenzyl-5-sulfanylidene-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-dien-3-one
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Synonyms:
3,7-dibenzyl-2-sulfanyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one;Oprea1_250526;STK062760;ZINC18116412;AKOS005388343;MCULE-7420727894;371780-86-8
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CAS No:
4,11-dibenzyl-5-sulfanylidene-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-dien-3-one Basic Attributes
419.6 g/mol
419.11260465 g/mol
Computed Properties
Molecular Weight:419.6
XLogP3:4.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:419.11260465
Monoisotopic Mass:419.11260465
Topological Polar Surface Area:95.9
Heavy Atom Count:29
Complexity:617
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 4,11-dibenzyl-5-sulfanylidene-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-dien-3-one
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