4-(ALLYLAMINO)-2-[(2-CHLOROBENZYL)SULFANYL]-6-PHENYL-5-PYRIMIDINECARBONITRILE
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![4-(ALLYLAMINO)-2-[(2-CHLOROBENZYL)SULFANYL]-6-PHENYL-5-PYRIMIDINECARBONITRILE structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/27397501b3e640f9b16fec49c9ded0a2.png "4-(ALLYLAMINO)-2-[(2-CHLOROBENZYL)SULFANYL]-6-PHENYL-5-PYRIMIDINECARBONITRILE")
4-(ALLYLAMINO)-2-[(2-CHLOROBENZYL)SULFANYL]-6-PHENYL-5-PYRIMIDINECARBONITRILE
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CAS No:
303985-72-0
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Formula:
C21H17ClN4S
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Chemical Name:
4-(ALLYLAMINO)-2-[(2-CHLOROBENZYL)SULFANYL]-6-PHENYL-5-PYRIMIDINECARBONITRILE
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Synonyms:
4-(allylamino)-2-[(2-chlorobenzyl)sulfanyl]-6-phenyl-5-pyrimidinecarbonitrile;2-{[(2-chlorophenyl)methyl]sulfanyl}-4-phenyl-6-[(prop-2-en-1-yl)amino]pyrimidine-5-carbonitrile;Bionet1_002930;HMS576O12;KS-00001RXF;ZINC4042148;AKOS005078143;MCULE-7088623561;11L-641S
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CAS No:
4-(ALLYLAMINO)-2-[(2-CHLOROBENZYL)SULFANYL]-6-PHENYL-5-PYRIMIDINECARBONITRILE Basic Attributes
392.9
392.086
Computed Properties
Molecular Weight:392.9
XLogP3:6.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:392.0862454
Monoisotopic Mass:392.0862454
Topological Polar Surface Area:86.9
Heavy Atom Count:27
Complexity:516
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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