Vitas-M small molecule compound
2-{[(3-nitrophenyl)carbonyl]amino}-N-(tetrahydrofuran-2-ylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STK876555
SMILES O=C(c1c(sc2c1CCCC2)NC(=O)c1cccc(c1)[N+](=O)[O-])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 C21H23N3O5S MW 429.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O5S/c25-19(13-5-3-6-14(11-13)24(27)28)23-21-18(16-8-1-2-9-17(16)30-21)20(26)22-12-15-7-4-10-29-15/h3,5-6,11,15H,1-2,4,7-10,12H2,(H,22,26)(H,23,25)InChIKey
PVRGYCALBXNRTD-UHFFFAOYSA-NSynonyms
378218-29-22(((3nitrophenyl)carbonyl)amino)N(tetrahydrofuran2ylmethyl)4567tetrahydro1benzothiophene3carboxamide
2((3nitrobenzoyl)amino)N(oxolan2ylmethyl)4567tetrahydro1benzothiophene3carboxamide
2(3nitrobenzamido)N((tetrahydrofuran2yl)methyl)4567tetrahydrobenzo(b)thiophene3carboxamide
378218292
C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC(=CC=C3)(N+)(=O)(O))C(=O)NCC4CCCO4
InChI=1SC21H23N3O5Sc2519(1353614(1113)24(27)28)232118(16812917(16)3021)20(26)22121574102915h3561115H12471012H2(H2226)(H2325)
MFCD02978014
O=C(c1c(sc2c1CCCC2)NC(=O)c1cccc(c1)(N+)(=O)(O))NCC1CCCO1
ZINC000001165866
ZINC000001165867
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