methyl 3-[[4-(3-methylpiperidin-1-yl)sulfonylphenyl]carbonylamino]-5-phenyl-thiophene-2-carboxylate

Systemtic Name: methyl 3-[[4-(3-methylpiperidin-1-yl)sulfonylphenyl]carbonylamino]-5-phenyl-thiophene-2-carboxylate Openeye Name: methyl 3-[[4-[(3-methyl-1-piperidyl)sulfonyl]benzoyl]amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[[4-[(3-methyl-1-piperidinyl)sulfonyl]phenyl]-oxomethyl]amino]-5-phenyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[4-(3-methylpiperidin-1-yl)sulfonylbenzoyl]amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[[4-(3-methylpiperidino)sulfonylbenzoyl]amino]-5-phenyl-thiophene-2-carboxylic acid methyl ester Formula: C25H26N2O5S2 MolecularWeight: 498.61434

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C(SC(=C3)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C(SC(=C3)C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C25H26N2O5S2/c1-17-7-6-14-27(16-17)34(30,31)20-12-10-19(11-13-20)24(28)26-21-15-22(18-8-4-3-5-9-18)33-23(21)25(29)32-2/h3-5,8-13,15,17H,6-7,14,16H2,1-2H3,(H,26,28)