2-azanyl-N-[2-[(1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]-2-oxidanylidene-ethyl]-4-methylsulfanyl-butanamide hydrochloride

Systemtic Name: 2-azanyl-N-[2-[(1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]-2-oxidanylidene-ethyl]-4-methylsulfanyl-butanamide hydrochloride Openeye Name: 2-amino-N-[2-[(2-amino-1-benzyl-2-oxo-ethyl)amino]-2-oxo-ethyl]-4-methylsulfanyl-butanamide hydrochloride CAS Name: 2-amino-N-[2-[(1-amino-1-oxo-3-phenylpropan-2-yl)amino]-2-oxoethyl]-4-(methylthio)butanamide hydrochloride IUPAC Name: 2-amino-N-[2-[(1-amino-1-oxo-3-phenylpropan-2-yl)amino]-2-oxoethyl]-4-methylsulfanylbutanamide hydrochloride Traditional Name: 2-amino-N-[2-[(2-amino-1-benzyl-2-keto-ethyl)amino]-2-keto-ethyl]-4-(methylthio)butyramide hydrochloride Formula: C16H25ClN4O3S MolecularWeight: 388.9127

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NCC(=O)NC(CC1=CC=CC=C1)C(=O)N)N.Cl

Isomeric SMILES

CSCCC(C(=O)NCC(=O)NC(CC1=CC=CC=C1)C(=O)N)N.Cl

InChI

InChI=1S/C16H24N4O3S.ClH/c1-24-8-7-12(17)16(23)19-10-14(21)20-13(15(18)22)9-11-5-3-2-4-6-11;/h2-6,12-13H,7-10,17H2,1H3,(H2,18,22)(H,19,23)(H,20,21);1H