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

Systemtic Name: tert-butyl 4-[[(4-ethylphenyl)-thiophen-2-yl-methyl]carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[(4-ethylphenyl)-(2-thienyl)methyl]carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[[(4-ethylphenyl)-thiophen-2-ylmethyl]amino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[(4-ethylphenyl)-thiophen-2-ylmethyl]carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[[(4-ethylphenyl)-(2-thienyl)methyl]carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C24H32N2O3S MolecularWeight: 428.58748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C24H32N2O3S/c1-5-17-8-10-18(11-9-17)21(20-7-6-16-30-20)25-22(27)19-12-14-26(15-13-19)23(28)29-24(2,3)4/h6-11,16,19,21H,5,12-15H2,1-4H3,(H,25,27)