4-[[1-[(1-azanyl-1-sulfanylidene-propan-2-yl)-naphthalen-2-yl-amino]-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]-methyl-carbamoyl]piperidine-1-carboxylic acid

Systemtic Name: 4-[[1-[(1-azanyl-1-sulfanylidene-propan-2-yl)-naphthalen-2-yl-amino]-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]-methyl-carbamoyl]piperidine-1-carboxylic acid Openeye Name: 4-[[2-[(2-amino-1-methyl-2-thioxo-ethyl)-(2-naphthyl)amino]-1-(2-naphthylmethyl)-2-oxo-ethyl]-methyl-carbamoyl]piperidine-1-carboxylic acid CAS Name: 4-[[[1-[(1-amino-1-sulfanylidenepropan-2-yl)-(2-naphthalenyl)amino]-3-(2-naphthalenyl)-1-oxopropan-2-yl]-methylamino]-oxomethyl]-1-piperidinecarboxylic acid IUPAC Name: 4-[[1-[(1-amino-1-sulfanylidenepropan-2-yl)-naphthalen-2-ylamino]-3-naphthalen-2-yl-1-oxopropan-2-yl]-methylcarbamoyl]piperidine-1-carboxylic acid Traditional Name: 4-[[2-[(2-amino-1-methyl-2-thioxo-ethyl)-(2-naphthyl)amino]-2-keto-1-(2-naphthylmethyl)ethyl]-methyl-carbamoyl]piperidine-1-carboxylic acid Formula: C34H36N4O4S MolecularWeight: 596.73904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=S)N)N(C1=CC2=CC=CC=C2C=C1)C(=O)C(CC3=CC4=CC=CC=C4C=C3)N(C)C(=O)C5CCN(CC5)C(=O)O

Isomeric SMILES

CC(C(=S)N)N(C1=CC2=CC=CC=C2C=C1)C(=O)C(CC3=CC4=CC=CC=C4C=C3)N(C)C(=O)C5CCN(CC5)C(=O)O

InChI

InChI=1S/C34H36N4O4S/c1-22(31(35)43)38(29-14-13-25-8-4-6-10-28(25)21-29)33(40)30(20-23-11-12-24-7-3-5-9-27(24)19-23)36(2)32(39)26-15-17-37(18-16-26)34(41)42/h3-14,19,21-22,26,30H,15-18,20H2,1-2H3,(H2,35,43)(H,41,42)