Vitas-M small molecule compound

N-(3-methoxypropyl)-2-{[(4-nitrophenyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Catalog ID
STK811675
SMILES COCCCNC(=O)c1c(sc2c1CCCC2)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 C20H23N3O5S MW 417.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N3O5S/c1-28-12-4-11-21-19(25)17-15-5-2-3-6-16(15)29-20(17)22-18(24)13-7-9-14(10-8-13)23(26)27/h7-10H,2-6,11-12H2,1H3,(H,21,25)(H,22,24)
InChIKey
IWWMUJANWCEDOQ-UHFFFAOYSA-N
Synonyms
608490-77-3
608490773
COCCCNC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=CC=C(C=C3)(N+)(=O)(O)
COCCCNC(=O)c1c(sc2c1CCCC2)NC(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC20H23N3O5Sc128124112119(25)1715523616(15)2920(17)2218(24)137914(10813)23(26)27h710H261112H21H3(H2125)(H2224)
MFCD03710337
N(3methoxypropyl)2(((4nitrophenyl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxamide
N(3methoxypropyl)2((4nitrobenzoyl)amino)4567tetrahydro1benzothiophene3carboxamide
ZINC000003003929
ZINC03003929
ZINC3003929

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Available files

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