Vitas-M small molecule compound

methyl 4-carbamoyl-3-methyl-5-{[(3-nitrophenyl)carbonyl]amino}thiophene-2-carboxylate

Catalog ID
STK421500
SMILES COC(=O)c1sc(c(c1C)C(=O)N)NC(=O)c1cccc(c1)[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 C15H13N3O6S MW 363.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13N3O6S/c1-7-10(12(16)19)14(25-11(7)15(21)24-2)17-13(20)8-4-3-5-9(6-8)18(22)23/h3-6H,1-2H3,(H2,16,19)(H,17,20)
InChIKey
LDOYCIDBUXMHGQ-UHFFFAOYSA-N
Synonyms
353471-91-7
353471917
CC1=C(SC(=C1C(=O)N)NC(=O)C2=CC(=CC=C2)(N+)(=O)(O))C(=O)OC
COC(=O)c1sc(c(c1C)C(=O)N)NC(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC15H13N3O6Sc1710(12(16)19)14(2511(7)15(21)242)1713(20)84359(68)18(22)23h36H12H3(H21619)(H1720)
METHYL4(AMINOCARBONYL)5((3NITROBENZOYL)AMINO)3METHYL2THIOPHENECARBOXYLATE
methyl4carbamoyl3methyl5(((3nitrophenyl)carbonyl)amino)thiophene2carboxylate
METHYL4CARBAMOYL3METHYL5((3NITROBENZOYL)AMINO)THIOPHENE2CARBOXYLATE
METHYL4CARBAMOYL3METHYL5(3NITROBENZAMIDO)THIOPHENE2CARBOXYLATE
MFCD01339188
ZINC000002081417
ZINC02081417
ZINC2081417

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.