[1-[[1-(cyclopropylsulfanylcarbamoylamino)-3-phenyl-propan-2-yl]-methyl-amino]-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]-methyl-carbamic acid

Systemtic Name: [1-[[1-(cyclopropylsulfanylcarbamoylamino)-3-phenyl-propan-2-yl]-methyl-amino]-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]-methyl-carbamic acid Openeye Name: [2-[[1-benzyl-2-(cyclopropylsulfanylcarbamoylamino)ethyl]-methyl-amino]-1-(2-naphthylmethyl)-2-oxo-ethyl]-methyl-carbamic acid CAS Name: [1-[[1-[[[(cyclopropylthio)amino]-oxomethyl]amino]-3-phenylpropan-2-yl]-methylamino]-3-(2-naphthalenyl)-1-oxopropan-2-yl]-methylcarbamic acid IUPAC Name: [1-[[1-(cyclopropylsulfanylcarbamoylamino)-3-phenylpropan-2-yl]-methylamino]-3-naphthalen-2-yl-1-oxopropan-2-yl]-methylcarbamic acid Traditional Name: [2-[[1-benzyl-2-[(cyclopropylthio)carbamoylamino]ethyl]-methyl-amino]-2-keto-1-(2-naphthylmethyl)ethyl]-methyl-carbamic acid Formula: C29H34N4O4S MolecularWeight: 534.66966

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(CC1=CC=CC=C1)CNC(=O)NSC2CC2)C(=O)C(CC3=CC4=CC=CC=C4C=C3)N(C)C(=O)O

Isomeric SMILES

CN(C(CC1=CC=CC=C1)CNC(=O)NSC2CC2)C(=O)C(CC3=CC4=CC=CC=C4C=C3)N(C)C(=O)O

InChI

InChI=1S/C29H34N4O4S/c1-32(24(17-20-8-4-3-5-9-20)19-30-28(35)31-38-25-14-15-25)27(34)26(33(2)29(36)37)18-21-12-13-22-10-6-7-11-23(22)16-21/h3-13,16,24-26H,14-15,17-19H2,1-2H3,(H,36,37)(H2,30,31,35)