5-oxidanylidene-5-[2-[1-(phenylmethyl)piperidin-4-yl]ethylamino]-2-(thiophen-2-ylcarbonylamino)pentanoic acid

Systemtic Name: 5-oxidanylidene-5-[2-[1-(phenylmethyl)piperidin-4-yl]ethylamino]-2-(thiophen-2-ylcarbonylamino)pentanoic acid Openeye Name: 5-[2-(1-benzyl-4-piperidyl)ethylamino]-5-oxo-2-(thiophene-2-carbonylamino)pentanoic acid CAS Name: 5-oxo-2-[[oxo(thiophen-2-yl)methyl]amino]-5-[2-[1-(phenylmethyl)-4-piperidinyl]ethylamino]pentanoic acid IUPAC Name: 5-[2-(1-benzylpiperidin-4-yl)ethylamino]-5-oxo-2-(thiophene-2-carbonylamino)pentanoic acid Traditional Name: 5-[2-(1-benzyl-4-piperidyl)ethylamino]-5-keto-2-(2-thenoylamino)valeric acid Formula: C24H31N3O4S MolecularWeight: 457.58564

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCNC(=O)CCC(C(=O)O)NC(=O)C2=CC=CS2)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1CCNC(=O)CCC(C(=O)O)NC(=O)C2=CC=CS2)CC3=CC=CC=C3

InChI

InChI=1S/C24H31N3O4S/c28-22(9-8-20(24(30)31)26-23(29)21-7-4-16-32-21)25-13-10-18-11-14-27(15-12-18)17-19-5-2-1-3-6-19/h1-7,16,18,20H,8-15,17H2,(H,25,28)(H,26,29)(H,30,31)