N-(2-azanyl-3-phenyl-propanoyl)-4-methyl-N-[1-oxidanylidene-1-(sulfanylmethylamino)propan-2-yl]pentanamide

Systemtic Name: N-(2-azanyl-3-phenyl-propanoyl)-4-methyl-N-[1-oxidanylidene-1-(sulfanylmethylamino)propan-2-yl]pentanamide Openeye Name: N-(2-amino-3-phenyl-propanoyl)-4-methyl-N-[1-methyl-2-oxo-2-(sulfanylmethylamino)ethyl]pentanamide CAS Name: N-(2-amino-1-oxo-3-phenylpropyl)-N-[1-(mercaptomethylamino)-1-oxopropan-2-yl]-4-methylpentanamide IUPAC Name: N-(2-amino-3-phenylpropanoyl)-4-methyl-N-[1-oxo-1-(sulfanylmethylamino)propan-2-yl]pentanamide Traditional Name: N-[2-keto-2-(mercaptomethylamino)-1-methyl-ethyl]-4-methyl-N-phenylalanyl-valeramide Formula: C19H29N3O3S MolecularWeight: 379.51686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)N(C(C)C(=O)NCS)C(=O)C(CC1=CC=CC=C1)N

Isomeric SMILES

CC(C)CCC(=O)N(C(C)C(=O)NCS)C(=O)C(CC1=CC=CC=C1)N

InChI

InChI=1S/C19H29N3O3S/c1-13(2)9-10-17(23)22(14(3)18(24)21-12-26)19(25)16(20)11-15-7-5-4-6-8-15/h4-8,13-14,16,26H,9-12,20H2,1-3H3,(H,21,24)