Vitas-M small molecule compound
N-[2-({2-[(3-methylphenyl)amino]-2-oxoethyl}sulfanyl)-1,3-benzothiazol-6-yl]-4-nitrobenzamide
Catalog ID
STK087709
SMILES O=C(Nc1cccc(c1)C)CSc1nc2c(s1)cc(cc2)NC(=O)c1ccc(cc1)[N+](=O)[O-]
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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 C23H18N4O4S2 MW 478.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18N4O4S2/c1-14-3-2-4-16(11-14)24-21(28)13-32-23-26-19-10-7-17(12-20(19)33-23)25-22(29)15-5-8-18(9-6-15)27(30)31/h2-12H,13H2,1H3,(H,24,28)(H,25,29)InChIKey
RISJFPDKCKDFAK-UHFFFAOYSA-NSynonyms
CC1=CC(=CC=C1)NC(=O)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC23H18N4O4S2c11432416(1114)2421(28)133223261910717(1220(19)3323)2522(29)155818(9615)27(30)31h212H13H21H3(H2428)(H2529)
MFCD03355927
N(2((2((3METHYLPHENYL)AMINO)2OXOETHYL)SULFANYL)13BENZOTHIAZOL6YL)4NITROBENZAMIDE
N(2(2(3METHYLANILINO)2OXOETHYL)SULFANYL13BENZOTHIAZOL6YL)4NITROBENZAMIDE
O=C(Nc1cccc(c1)C)CSc1nc2c(s1)cc(cc2)NC(=O)c1ccc(cc1)(N+)(=O)(O)
STK087709
ZINC000002819346
ZINC02819346
ZINC2819346
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