methyl 3-[4-[1-[methyl(thiophen-3-ylcarbonyl)amino]-2-phenyl-ethyl]piperidin-1-yl]carbonylbenzoate

Systemtic Name: methyl 3-[4-[1-[methyl(thiophen-3-ylcarbonyl)amino]-2-phenyl-ethyl]piperidin-1-yl]carbonylbenzoate Openeye Name: methyl 3-[4-[1-[methyl(thiophene-3-carbonyl)amino]-2-phenyl-ethyl]piperidine-1-carbonyl]benzoate CAS Name: 3-[[4-[1-[methyl-[oxo(3-thiophenyl)methyl]amino]-2-phenylethyl]-1-piperidinyl]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 3-[4-[1-[methyl(thiophene-3-carbonyl)amino]-2-phenylethyl]piperidine-1-carbonyl]benzoate Traditional Name: 3-[4-[1-[methyl(3-thenoyl)amino]-2-phenyl-ethyl]piperidine-1-carbonyl]benzoic acid methyl ester Formula: C28H30N2O4S MolecularWeight: 490.6138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C(CC1=CC=CC=C1)C2CCN(CC2)C(=O)C3=CC(=CC=C3)C(=O)OC)C(=O)C4=CSC=C4

Isomeric SMILES

CN(C(CC1=CC=CC=C1)C2CCN(CC2)C(=O)C3=CC(=CC=C3)C(=O)OC)C(=O)C4=CSC=C4

InChI

InChI=1S/C28H30N2O4S/c1-29(26(31)24-13-16-35-19-24)25(17-20-7-4-3-5-8-20)21-11-14-30(15-12-21)27(32)22-9-6-10-23(18-22)28(33)34-2/h3-10,13,16,18-19,21,25H,11-12,14-15,17H2,1-2H3