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

Systemtic Name: N-[1-[(1-azanyl-4-methyl-1-oxidanylidene-pentan-2-yl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]-4-methyl-2-(sulfanylmethyl)pentanamide Openeye Name: N-[1-benzyl-2-[(1-carbamoyl-3-methyl-butyl)amino]-2-oxo-ethyl]-4-methyl-2-(sulfanylmethyl)pentanamide CAS Name: N-[1-[(1-amino-4-methyl-1-oxopentan-2-yl)amino]-1-oxo-3-phenylpropan-2-yl]-2-(mercaptomethyl)-4-methylpentanamide IUPAC Name: N-[1-[(1-amino-4-methyl-1-oxopentan-2-yl)amino]-1-oxo-3-phenylpropan-2-yl]-4-methyl-2-(sulfanylmethyl)pentanamide Traditional Name: N-[1-benzyl-2-[(1-carbamoyl-3-methyl-butyl)amino]-2-keto-ethyl]-2-(mercaptomethyl)-4-methyl-valeramide Formula: C22H35N3O3S MolecularWeight: 421.5966

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H35N3O3S/c1-14(2)10-17(13-29)21(27)25-19(12-16-8-6-5-7-9-16)22(28)24-18(20(23)26)11-15(3)4/h5-9,14-15,17-19,29H,10-13H2,1-4H3,(H2,23,26)(H,24,28)(H,25,27)