1-(1-oxidanylpropoxy)ethyl 3-[(4-methylcyclohexyl)carbonyl-(1-methylpiperidin-4-yl)amino]-5-phenyl-thiophene-2-carboxylate

Systemtic Name: 1-(1-oxidanylpropoxy)ethyl 3-[(4-methylcyclohexyl)carbonyl-(1-methylpiperidin-4-yl)amino]-5-phenyl-thiophene-2-carboxylate Openeye Name: 1-(1-hydroxypropoxy)ethyl 3-[(4-methylcyclohexanecarbonyl)-(1-methyl-4-piperidyl)amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[(4-methylcyclohexyl)-oxomethyl]-(1-methyl-4-piperidinyl)amino]-5-phenyl-2-thiophenecarboxylic acid 1-(1-hydroxypropoxy)ethyl ester IUPAC Name: 1-(1-hydroxypropoxy)ethyl 3-[(4-methylcyclohexanecarbonyl)-(1-methylpiperidin-4-yl)amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[(4-methylcyclohexanecarbonyl)-(1-methyl-4-piperidyl)amino]-5-phenyl-thiophene-2-carboxylic acid 1-(1-hydroxypropoxy)ethyl ester Formula: C30H42N2O5S MolecularWeight: 542.72988

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Descriptors Computed from Structure

Canonical SMILES:

CCC(O)OC(C)OC(=O)C1=C(C=C(S1)C2=CC=CC=C2)N(C3CCN(CC3)C)C(=O)C4CCC(CC4)C

Isomeric SMILES

CCC(O)OC(C)OC(=O)C1=C(C=C(S1)C2=CC=CC=C2)N(C3CCN(CC3)C)C(=O)C4CCC(CC4)C

InChI

InChI=1S/C30H42N2O5S/c1-5-27(33)36-21(3)37-30(35)28-25(19-26(38-28)22-9-7-6-8-10-22)32(24-15-17-31(4)18-16-24)29(34)23-13-11-20(2)12-14-23/h6-10,19-21,23-24,27,33H,5,11-18H2,1-4H3