Vitas-M small molecule compound
(2E)-2-(1,3-benzothiazol-2-yl)-3-(7-methoxy-2-oxo-1,2-dihydroquinolin-3-yl)prop-2-enenitrile
Catalog ID
STK632280
SMILES COc1ccc2c(c1)[nH]c(=O)c(c2)/C=C(/c1nc2c(s1)cccc2)\C#N
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C20H13N3O2S MW 359.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13N3O2S/c1-25-15-7-6-12-8-13(19(24)22-17(12)10-15)9-14(11-21)20-23-16-4-2-3-5-18(16)26-20/h2-10H,1H3,(H,22,24)/b14-9+InChIKey
LLYSSTROJAUZFY-NTEUORMPSA-NSynonyms
924821-58-9(2E)2(13benzothiazol2yl)3(7methoxy2oxo12dihydroquinolin3yl)prop2enenitrile
(2E)2BENZOTHIAZOL2YL3(2HYDROXY7METHOXY(3QUINOLYL))PROP2ENENITRILE
(E)2(13benzothiazol2yl)3(7methoxy2oxo1Hquinolin3yl)prop2enenitrile
COC1=CC2=C(C=C1)C=C(C(=O)N2)C=C(C#N)C3=NC4=CC=CC=C4S3
COc1ccc2c(c1)(nH)c(=O)c(c2)C=C(c1nc2c(s1)cccc2)C#N
InChI=1SC20H13N3O2Sc125157612813(19(24)2217(12)1015)914(1121)202316423518(16)2620h210H1H3(H2224)b149+
MFCD18159728
ZINC000009134151
ZINC09134151
ZINC9134151
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