Vitas-M small molecule compound
propyl 4-[4-(butan-2-yl)phenyl]-2-{[(4-nitrophenyl)carbonyl]amino}thiophene-3-carboxylate
Catalog ID
STK420109
SMILES CCCOC(=O)c1c(scc1c1ccc(cc1)C(CC)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 C25H26N2O5S MW 466.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N2O5S/c1-4-14-32-25(29)22-21(18-8-6-17(7-9-18)16(3)5-2)15-33-24(22)26-23(28)19-10-12-20(13-11-19)27(30)31/h6-13,15-16H,4-5,14H2,1-3H3,(H,26,28)InChIKey
XOTHBVKFAXMRSH-UHFFFAOYSA-NSynonyms
444925-24-0444925240
CCCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C(C)CC)NC(=O)C3=CC=C(C=C3)(N+)(=O)(O)
CCCOC(=O)c1c(scc1c1ccc(cc1)C(CC)C)NC(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC25H26N2O5Sc14143225(29)2221(188617(7918)16(3)52)153324(22)2623(28)19101220(131119)27(30)31h6131516H4514H213H3(H2628)
MFCD02372373
propyl4(4(butan2yl)phenyl)2(((4nitrophenyl)carbonyl)amino)thiophene3carboxylate
PROPYL4(4BUTAN2YLPHENYL)2((4NITROBENZOYL)AMINO)THIOPHENE3CARBOXYLATE
PROPYL4(4SECBUTYLPHENYL)2((4NITROBENZOYL)AMINO)3THIOPHENECARBOXYLATE
ZINC000002089642
ZINC000002089643
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