5-[2-(DIMETHYLAMINO)VINYL]-3-[(4-METHYLBENZYL)SULFANYL]-4-ISOTHIAZOLECARBONITRILE

CAS No.
338778-59-9
CCD No.
CCD00066786
Formula
C16 H17 N3 S2
MolWeight
315.463

Basic Information

Product Name: 5-[2-(DIMETHYLAMINO)VINYL]-3-[(4-METHYLBENZYL)SULFANYL]-4-ISOTHIAZOLECARBONITRILE
CAS: 338778-59-9
English Synonyms: 5-[2-(DIMETHYLAMINO)VINYL]-3-[(4-METHYLBENZYL)SULFANYL]-4-ISOTHIAZOLECARBONITRILE
MDL Number.: MFCD00138533
H bond acceptor: 3
H bond donor: 0
Smile: Cc1ccc(cc1)CSc2c(c(sn2)/C=C/N(C)C)C#N
InChi: InChI=1S/C16H17N3S2/c1-12-4-6-13(7-5-12)11-20-16-14(10-17)15(21-18-16)8-9-19(2)3/h4-9H,11H2,1-3H3/b9-8+
InChiKey: InChIKey=YQTWLZPVQVBFFK-CMDGGOBGSA-N

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