2-acetamido-N-[1-[(1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-methyl-pentanamide

Systemtic Name: 2-acetamido-N-[1-[(1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-methyl-pentanamide Openeye Name: 2-acetamido-N-[1-[(2-amino-1-benzyl-2-oxo-ethyl)carbamoyl]-3-methylsulfanyl-propyl]-3-methyl-pentanamide CAS Name: 2-acetamido-N-[1-[(1-amino-1-oxo-3-phenylpropan-2-yl)amino]-4-(methylthio)-1-oxobutan-2-yl]-3-methylpentanamide IUPAC Name: 2-acetamido-N-[1-[(1-amino-1-oxo-3-phenylpropan-2-yl)amino]-4-methylsulfanyl-1-oxobutan-2-yl]-3-methylpentanamide Traditional Name: 2-acetamido-N-[1-[(2-amino-1-benzyl-2-keto-ethyl)carbamoyl]-3-(methylthio)propyl]-3-methyl-valeramide Formula: C22H34N4O4S MolecularWeight: 450.59476

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(CCSC)C(=O)NC(CC1=CC=CC=C1)C(=O)N)NC(=O)C

Isomeric SMILES

CCC(C)C(C(=O)NC(CCSC)C(=O)NC(CC1=CC=CC=C1)C(=O)N)NC(=O)C

InChI

InChI=1S/C22H34N4O4S/c1-5-14(2)19(24-15(3)27)22(30)25-17(11-12-31-4)21(29)26-18(20(23)28)13-16-9-7-6-8-10-16/h6-10,14,17-19H,5,11-13H2,1-4H3,(H2,23,28)(H,24,27)(H,25,30)(H,26,29)