(E)-2-cyano-3-[4-(dimethylamino)phenyl]prop-2-enethioamide
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![(E)-2-cyano-3-[4-(dimethylamino)phenyl]prop-2-enethioamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/170ed718f8c148c5aea089d3a682495a.png "(E)-2-cyano-3-[4-(dimethylamino)phenyl]prop-2-enethioamide")
(E)-2-cyano-3-[4-(dimethylamino)phenyl]prop-2-enethioamide
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CAS No:
68029-58-3
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Formula:
C12H13N3S
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Chemical Name:
(E)-2-cyano-3-[4-(dimethylamino)phenyl]prop-2-enethioamide
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Synonyms:
2-Cyano-3-[4-(dimethylamino)phenyl]thioacrylamide;68029-58-3;NSC275413;CHEMBL1927524;(E)-2-cyano-3-[4-(dimethylamino)phenyl]prop-2-enethioamide;ZINC1562525;AKOS003581260;NSC-275413;F6782-3789;(2E)-2-CYANO-3-[4-(DIMETHYLAMINO)PHENYL]PROP-2-ENETHIOAMIDE
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CAS No:
(E)-2-cyano-3-[4-(dimethylamino)phenyl]prop-2-enethioamide Basic Attributes
231.32 g/mol
231.08301860 g/mol
275413
Computed Properties
Molecular Weight:231.32
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:231.08301860
Monoisotopic Mass:231.08301860
Topological Polar Surface Area:85.1
Heavy Atom Count:16
Complexity:329
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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