(2S)-2-azanyl-4-methyl-N-[(2S)-1-oxidanylidene-1-[(2-oxidanylidene-3-sulfanyl-propyl)amino]-3-phenyl-propan-2-yl]pentanamide

Systemtic Name: (2S)-2-azanyl-4-methyl-N-[(2S)-1-oxidanylidene-1-[(2-oxidanylidene-3-sulfanyl-propyl)amino]-3-phenyl-propan-2-yl]pentanamide Openeye Name: (2S)-2-amino-N-[(1S)-1-benzyl-2-oxo-2-[(2-oxo-3-sulfanyl-propyl)amino]ethyl]-4-methyl-pentanamide CAS Name: (2S)-2-amino-N-[(2S)-1-[(3-mercapto-2-oxopropyl)amino]-1-oxo-3-phenylpropan-2-yl]-4-methylpentanamide IUPAC Name: (2S)-2-amino-4-methyl-N-[(2S)-1-oxo-1-[(2-oxo-3-sulfanylpropyl)amino]-3-phenylpropan-2-yl]pentanamide Traditional Name: (2S)-2-amino-N-[(1S)-1-benzyl-2-keto-2-[(2-keto-3-mercapto-propyl)amino]ethyl]-4-methyl-valeramide Formula: C18H27N3O3S MolecularWeight: 365.49028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)NCC(=O)CS)N

Isomeric SMILES

CC(C)C[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCC(=O)CS)N

InChI

InChI=1S/C18H27N3O3S/c1-12(2)8-15(19)17(23)21-16(9-13-6-4-3-5-7-13)18(24)20-10-14(22)11-25/h3-7,12,15-16,25H,8-11,19H2,1-2H3,(H,20,24)(H,21,23)/t15-,16-/m0/s1