N-[(3-methoxyphenyl)methyl]-2-propan-2-ylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[(3-methoxyphenyl)methyl]-2-propan-2-ylsulfanyl-pyridine-3-carboxamide Openeye Name: 2-isopropylsulfanyl-N-[(3-methoxyphenyl)methyl]pyridine-3-carboxamide CAS Name: N-[(3-methoxyphenyl)methyl]-2-(propan-2-ylthio)-3-pyridinecarboxamide IUPAC Name: N-[(3-methoxyphenyl)methyl]-2-propan-2-ylsulfanylpyridine-3-carboxamide Traditional Name: 2-(isopropylthio)-N-m-anisyl-nicotinamide Formula: C17H20N2O2S MolecularWeight: 316.4179

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=C(C=CC=N1)C(=O)NCC2=CC(=CC=C2)OC

Isomeric SMILES

CC(C)SC1=C(C=CC=N1)C(=O)NCC2=CC(=CC=C2)OC

InChI

InChI=1S/C17H20N2O2S/c1-12(2)22-17-15(8-5-9-18-17)16(20)19-11-13-6-4-7-14(10-13)21-3/h4-10,12H,11H2,1-3H3,(H,19,20)