(phenylmethyl) N-[(2S)-1-[(4,6-dimethylpyridin-2-yl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-[(4,6-dimethylpyridin-2-yl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-1-[(4,6-dimethyl-2-pyridyl)carbamoyl]-3-methylsulfanyl-propyl]carbamate CAS Name: N-[(2S)-1-[(4,6-dimethyl-2-pyridinyl)amino]-4-(methylthio)-1-oxobutan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-[(4,6-dimethylpyridin-2-yl)amino]-4-methylsulfanyl-1-oxobutan-2-yl]carbamate Traditional Name: N-[(1S)-1-[(4,6-dimethyl-2-pyridyl)carbamoyl]-3-(methylthio)propyl]carbamic acid benzyl ester Formula: C20H25N3O3S MolecularWeight: 387.4958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1)NC(=O)C(CCSC)NC(=O)OCC2=CC=CC=C2)C

Isomeric SMILES

CC1=CC(=NC(=C1)NC(=O)[C@H](CCSC)NC(=O)OCC2=CC=CC=C2)C

InChI

InChI=1S/C20H25N3O3S/c1-14-11-15(2)21-18(12-14)23-19(24)17(9-10-27-3)22-20(25)26-13-16-7-5-4-6-8-16/h4-8,11-12,17H,9-10,13H2,1-3H3,(H,22,25)(H,21,23,24)/t17-/m0/s1