Vitas-M small molecule compound
(2E)-N-[4-(1,3-benzothiazol-2-yl)benzyl]-3-[5-(2-nitrophenyl)furan-2-yl]prop-2-enamide
Catalog ID
STK206448
SMILES O=C(/C=C/c1ccc(o1)c1ccccc1[N+](=O)[O-])NCc1ccc(cc1)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 C27H19N3O4S MW 481.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19N3O4S/c31-26(16-14-20-13-15-24(34-20)21-5-1-3-7-23(21)30(32)33)28-17-18-9-11-19(12-10-18)27-29-22-6-2-4-8-25(22)35-27/h1-16H,17H2,(H,28,31)/b16-14+InChIKey
ZXWZXYFVWHDSMT-JQIJEIRASA-NSynonyms
(2E)N(4(13BENZOTHIAZOL2YL)BENZYL)3(5(2NITROPHENYL)FURAN2YL)PROP2ENAMIDE
(E)N((4(13benzothiazol2yl)phenyl)methyl)3(5(2nitrophenyl)furan2yl)prop2enamide
C1=CC=C(C(=C1)C2=CC=C(O2)C=CC(=O)NCC3=CC=C(C=C3)C4=NC5=CC=CC=C5S4)(N+)(=O)(O)
InChI=1SC27H19N3O4Sc3126(161420131524(3420)21513723(21)30(32)33)28171891119(121018)272922624825(22)3527h116H17H2(H2831)b1614+
MFCD06666877
O=C(C=Cc1ccc(o1)c1ccccc1(N+)(=O)(O))NCc1ccc(cc1)c1nc2c(s1)cccc2
ZINC000009972120
ZINC09972120
ZINC9972120
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