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

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

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C(SC(=C3)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C(SC(=C3)C4=CC=CC=C4)C(=O)OC

InChI

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