(2S)-2-(aminocarbonylamino)-N-[(4,6-dimethyl-2-oxidanylidene-1H-pyridin-3-yl)methyl]-4-methylsulfanyl-butanamide

Systemtic Name: (2S)-2-(aminocarbonylamino)-N-[(4,6-dimethyl-2-oxidanylidene-1H-pyridin-3-yl)methyl]-4-methylsulfanyl-butanamide Openeye Name: (2S)-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-4-methylsulfanyl-2-ureido-butanamide CAS Name: (2S)-2-(carbamoylamino)-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-4-(methylthio)butanamide IUPAC Name: (2S)-2-(carbamoylamino)-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-4-methylsulfanylbutanamide Traditional Name: (2S)-N-[(2-keto-4,6-dimethyl-1H-pyridin-3-yl)methyl]-4-(methylthio)-2-ureido-butyramide Formula: C14H22N4O3S MolecularWeight: 326.41448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=O)N1)CNC(=O)C(CCSC)NC(=O)N)C

Isomeric SMILES

CC1=CC(=C(C(=O)N1)CNC(=O)[C@H](CCSC)NC(=O)N)C

InChI

InChI=1S/C14H22N4O3S/c1-8-6-9(2)17-12(19)10(8)7-16-13(20)11(4-5-22-3)18-14(15)21/h6,11H,4-5,7H2,1-3H3,(H,16,20)(H,17,19)(H3,15,18,21)/t11-/m0/s1