Vitas-M small molecule compound
propyl 4-(4-cyclohexylphenyl)-5-methyl-2-{[(4-nitrophenyl)carbonyl]amino}thiophene-3-carboxylate
Catalog ID
STK426273
SMILES CCCOC(=O)c1c(sc(c1c1ccc(cc1)C1CCCCC1)C)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 C28H30N2O5S MW 506.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N2O5S/c1-3-17-35-28(32)25-24(21-11-9-20(10-12-21)19-7-5-4-6-8-19)18(2)36-27(25)29-26(31)22-13-15-23(16-14-22)30(33)34/h9-16,19H,3-8,17H2,1-2H3,(H,29,31)InChIKey
KNRPMZKTRJQGIO-UHFFFAOYSA-NSynonyms
CCCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)C3CCCCC3)C)NC(=O)C4=CC=C(C=C4)(N+)(=O)(O)
CCCOC(=O)c1c(sc(c1c1ccc(cc1)C1CCCCC1)C)NC(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC28H30N2O5Sc13173528(32)2524(2111920(101221)197546819)18(2)3627(25)2926(31)22131523(161422)30(33)34h91619H3817H212H3(H2931)
MFCD02606129
PROPYL4(4CYCLOHEXYLPHENYL)2((4NITROBENZOYL)AMINO)5METHYL3THIOPHENECARBOXYLATE
propyl4(4cyclohexylphenyl)5methyl2(((4nitrophenyl)carbonyl)amino)thiophene3carboxylate
PROPYL4(4CYCLOHEXYLPHENYL)5METHYL2((4NITROBENZOYL)AMINO)THIOPHENE3CARBOXYLATE
PROPYL4(4CYCLOHEXYLPHENYL)5METHYL2((4NITROPHENYL)CARBONYLAMINO)THIOPHENE3CARBOXYLATE
ZINC000002110715
ZINC02110715
ZINC2110715
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