2-(3,4-dimethylphenyl)sulfanyl-N-[(2S)-1-methoxypropan-2-yl]pyridine-3-carboxamide

Systemtic Name: 2-(3,4-dimethylphenyl)sulfanyl-N-[(2S)-1-methoxypropan-2-yl]pyridine-3-carboxamide Openeye Name: 2-(3,4-dimethylphenyl)sulfanyl-N-[(1S)-2-methoxy-1-methyl-ethyl]pyridine-3-carboxamide CAS Name: 2-[(3,4-dimethylphenyl)thio]-N-[(2S)-1-methoxypropan-2-yl]-3-pyridinecarboxamide IUPAC Name: 2-(3,4-dimethylphenyl)sulfanyl-N-[(2S)-1-methoxypropan-2-yl]pyridine-3-carboxamide Traditional Name: 2-[(3,4-dimethylphenyl)thio]-N-[(1S)-2-methoxy-1-methyl-ethyl]nicotinamide Formula: C18H22N2O2S MolecularWeight: 330.44448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SC2=C(C=CC=N2)C(=O)NC(C)COC)C

Isomeric SMILES

CC1=C(C=C(C=C1)SC2=C(C=CC=N2)C(=O)N[C@@H](C)COC)C

InChI

InChI=1S/C18H22N2O2S/c1-12-7-8-15(10-13(12)2)23-18-16(6-5-9-19-18)17(21)20-14(3)11-22-4/h5-10,14H,11H2,1-4H3,(H,20,21)/t14-/m0/s1