ethyl N-[4-methyl-1-[(2-methylsulfanylpyridin-3-yl)carbonylamino]pentan-2-yl]carbamate

Systemtic Name: ethyl N-[4-methyl-1-[(2-methylsulfanylpyridin-3-yl)carbonylamino]pentan-2-yl]carbamate Openeye Name: ethyl N-[3-methyl-1-[[(2-methylsulfanylpyridine-3-carbonyl)amino]methyl]butyl]carbamate CAS Name: N-[4-methyl-1-[[[2-(methylthio)-3-pyridinyl]-oxomethyl]amino]pentan-2-yl]carbamic acid ethyl ester IUPAC Name: ethyl N-[4-methyl-1-[(2-methylsulfanylpyridine-3-carbonyl)amino]pentan-2-yl]carbamate Traditional Name: N-[3-methyl-1-[[[2-(methylthio)nicotinoyl]amino]methyl]butyl]carbamic acid ethyl ester Formula: C16H25N3O3S MolecularWeight: 339.453

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(CC(C)C)CNC(=O)C1=C(N=CC=C1)SC

Isomeric SMILES

CCOC(=O)NC(CC(C)C)CNC(=O)C1=C(N=CC=C1)SC

InChI

InChI=1S/C16H25N3O3S/c1-5-22-16(21)19-12(9-11(2)3)10-18-14(20)13-7-6-8-17-15(13)23-4/h6-8,11-12H,5,9-10H2,1-4H3,(H,18,20)(H,19,21)