ethyl 1-[(S)-(2-benzamido-4,5-dimethyl-thiophen-3-yl)-thiophen-2-yl-methyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(S)-(2-benzamido-4,5-dimethyl-thiophen-3-yl)-thiophen-2-yl-methyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[(S)-(2-benzamido-4,5-dimethyl-3-thienyl)-(2-thienyl)methyl]piperidine-4-carboxylate CAS Name: 1-[(S)-(2-benzamido-4,5-dimethyl-3-thiophenyl)-thiophen-2-ylmethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(S)-(2-benzamido-4,5-dimethylthiophen-3-yl)-thiophen-2-ylmethyl]piperidine-4-carboxylate Traditional Name: 1-[(S)-(2-benzamido-4,5-dimethyl-3-thienyl)-(2-thienyl)methyl]isonipecotic acid ethyl ester Formula: C26H30N2O3S2 MolecularWeight: 482.658

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(C2=CC=CS2)C3=C(SC(=C3C)C)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1CCN(CC1)[C@H](C2=CC=CS2)C3=C(SC(=C3C)C)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H30N2O3S2/c1-4-31-26(30)20-12-14-28(15-13-20)23(21-11-8-16-32-21)22-17(2)18(3)33-25(22)27-24(29)19-9-6-5-7-10-19/h5-11,16,20,23H,4,12-15H2,1-3H3,(H,27,29)/t23-/m1/s1