Vitas-M small molecule compound
(2E)-N-[5-(1,3-benzothiazol-2-yl)-2-methoxyphenyl]-3-(3-nitrophenyl)prop-2-enamide
Catalog ID
STK323287
SMILES COc1ccc(cc1NC(=O)/C=C/c1cccc(c1)[N+](=O)[O-])c1nc2c(s1)cccc2
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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 C23H17N3O4S MW 431.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17N3O4S/c1-30-20-11-10-16(23-25-18-7-2-3-8-21(18)31-23)14-19(20)24-22(27)12-9-15-5-4-6-17(13-15)26(28)29/h2-14H,1H3,(H,24,27)/b12-9+InChIKey
DZFADAFJWCEZKP-FMIVXFBMSA-NSynonyms
(2E)N(5(13benzothiazol2yl)2methoxyphenyl)3(3nitrophenyl)prop2enamide
(2E)N(5BENZOTHIAZOL2YL2METHOXYPHENYL)3(3NITROPHENYL)PROP2ENAMIDE
(E)N(5(13BENZOTHIAZOL2YL)2METHOXYPHENYL)3(3NITROPHENYL)PROP2ENAMIDE
COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3S2)NC(=O)C=CC4=CC(=CC=C4)(N+)(=O)(O)
COc1ccc(cc1NC(=O)C=Cc1cccc(c1)(N+)(=O)(O))c1nc2c(s1)cccc2
InChI=1SC23H17N3O4Sc13020111016(232518723821(18)3123)1419(20)2422(27)1291554617(1315)26(28)29h214H1H3(H2427)b129+
MFCD03836383
ZINC000008919438
ZINC08919438
ZINC8919438
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