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

Systemtic Name: N-[(2S)-1-[[(2S)-1-azanyl-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]-4-methyl-2-(sulfanylmethyl)pentanamide Openeye Name: N-[(1S)-2-[[(1S)-2-amino-1-methyl-2-oxo-ethyl]amino]-1-benzyl-2-oxo-ethyl]-4-methyl-2-(sulfanylmethyl)pentanamide CAS Name: N-[(2S)-1-[[(2S)-1-amino-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-2-(mercaptomethyl)-4-methylpentanamide IUPAC Name: N-[(2S)-1-[[(2S)-1-amino-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-4-methyl-2-(sulfanylmethyl)pentanamide Traditional Name: N-[(1S)-2-[[(1S)-2-amino-2-keto-1-methyl-ethyl]amino]-1-benzyl-2-keto-ethyl]-2-(mercaptomethyl)-4-methyl-valeramide Formula: C19H29N3O3S MolecularWeight: 379.51686

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H29N3O3S/c1-12(2)9-15(11-26)18(24)22-16(10-14-7-5-4-6-8-14)19(25)21-13(3)17(20)23/h4-8,12-13,15-16,26H,9-11H2,1-3H3,(H2,20,23)(H,21,25)(H,22,24)/t13-,15?,16-/m0/s1