ethyl 4-[2-[[(R)-(4-ethylphenyl)-thiophen-2-yl-methyl]amino]ethanoylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[2-[[(R)-(4-ethylphenyl)-thiophen-2-yl-methyl]amino]ethanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[2-[[(R)-(4-ethylphenyl)-(2-thienyl)methyl]amino]acetyl]amino]piperidine-1-carboxylate CAS Name: 4-[[2-[[(R)-(4-ethylphenyl)-thiophen-2-ylmethyl]amino]-1-oxoethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-[[(R)-(4-ethylphenyl)-thiophen-2-ylmethyl]amino]acetyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[2-[[(R)-(4-ethylphenyl)-(2-thienyl)methyl]amino]acetyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC=CS2)NCC(=O)NC3CCN(CC3)C(=O)OCC

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](C2=CC=CS2)NCC(=O)NC3CCN(CC3)C(=O)OCC

InChI

InChI=1S/C23H31N3O3S/c1-3-17-7-9-18(10-8-17)22(20-6-5-15-30-20)24-16-21(27)25-19-11-13-26(14-12-19)23(28)29-4-2/h5-10,15,19,22,24H,3-4,11-14,16H2,1-2H3,(H,25,27)/t22-/m1/s1