tert-butyl 4-[[(S)-(4-methylphenyl)-thiophen-2-yl-methyl]carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[(S)-(4-methylphenyl)-thiophen-2-yl-methyl]carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[(S)-p-tolyl(2-thienyl)methyl]carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[[(S)-(4-methylphenyl)-thiophen-2-ylmethyl]amino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[(S)-(4-methylphenyl)-thiophen-2-ylmethyl]carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[[(S)-p-tolyl(2-thienyl)methyl]carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C23H30N2O3S MolecularWeight: 414.5609

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H](C2=CC=CS2)NC(=O)C3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C23H30N2O3S/c1-16-7-9-17(10-8-16)20(19-6-5-15-29-19)24-21(26)18-11-13-25(14-12-18)22(27)28-23(2,3)4/h5-10,15,18,20H,11-14H2,1-4H3,(H,24,26)/t20-/m0/s1