N-[(2,5-dimethoxyphenyl)methyl]-6-propylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[(2,5-dimethoxyphenyl)methyl]-6-propylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[(2,5-dimethoxyphenyl)methyl]-6-propylsulfanyl-pyridine-3-carboxamide CAS Name: N-[(2,5-dimethoxyphenyl)methyl]-6-(propylthio)-3-pyridinecarboxamide IUPAC Name: N-[(2,5-dimethoxyphenyl)methyl]-6-propylsulfanylpyridine-3-carboxamide Traditional Name: N-(2,5-dimethoxybenzyl)-6-(propylthio)nicotinamide Formula: C18H22N2O3S MolecularWeight: 346.44388

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC=C(C=C1)C(=O)NCC2=C(C=CC(=C2)OC)OC

Isomeric SMILES

CCCSC1=NC=C(C=C1)C(=O)NCC2=C(C=CC(=C2)OC)OC

InChI

InChI=1S/C18H22N2O3S/c1-4-9-24-17-8-5-13(11-19-17)18(21)20-12-14-10-15(22-2)6-7-16(14)23-3/h5-8,10-11H,4,9,12H2,1-3H3,(H,20,21)