Vitas-M small molecule compound
2-{[(4-chloro-3-nitrophenyl)carbonyl]amino}-N-(furan-2-ylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STK810571
SMILES O=C(c1c(sc2c1CCCC2)NC(=O)c1ccc(c(c1)[N+](=O)[O-])Cl)NCc1ccco1
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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 C21H18ClN3O5S MW 459.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN3O5S/c22-15-8-7-12(10-16(15)25(28)29)19(26)24-21-18(14-5-1-2-6-17(14)31-21)20(27)23-11-13-4-3-9-30-13/h3-4,7-10H,1-2,5-6,11H2,(H,23,27)(H,24,26)InChIKey
UDJNFGWHZHICFM-UHFFFAOYSA-NSynonyms
2(((4chloro3nitrophenyl)carbonyl)amino)N(furan2ylmethyl)4567tetrahydro1benzothiophene3carboxamide
2((4chloro3nitrobenzoyl)amino)N(furan2ylmethyl)4567tetrahydro1benzothiophene3carboxamide
C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC(=C(C=C3)Cl)(N+)(=O)(O))C(=O)NCC4=CC=CO4
InChI=1SC21H18ClN3O5Sc22158712(1016(15)25(28)29)19(26)242118(14512617(14)3121)20(27)2311134393013h34710H125611H2(H2327)(H2426)
MFCD03709205
O=C(c1c(sc2c1CCCC2)NC(=O)c1ccc(c(c1)(N+)(=O)(O))Cl)NCc1ccco1
ZINC000001159700
ZINC01159700
ZINC1159700
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