2-(2,5-dimethylphenyl)sulfanyl-N-[(3,4,5-trimethoxyphenyl)methyl]pyridine-3-carboxamide

Systemtic Name: 2-(2,5-dimethylphenyl)sulfanyl-N-[(3,4,5-trimethoxyphenyl)methyl]pyridine-3-carboxamide Openeye Name: 2-(2,5-dimethylphenyl)sulfanyl-N-[(3,4,5-trimethoxyphenyl)methyl]pyridine-3-carboxamide CAS Name: 2-[(2,5-dimethylphenyl)thio]-N-[(3,4,5-trimethoxyphenyl)methyl]-3-pyridinecarboxamide IUPAC Name: 2-(2,5-dimethylphenyl)sulfanyl-N-[(3,4,5-trimethoxyphenyl)methyl]pyridine-3-carboxamide Traditional Name: 2-[(2,5-dimethylphenyl)thio]-N-(3,4,5-trimethoxybenzyl)nicotinamide Formula: C24H26N2O4S MolecularWeight: 438.53924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SC2=C(C=CC=N2)C(=O)NCC3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)SC2=C(C=CC=N2)C(=O)NCC3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C24H26N2O4S/c1-15-8-9-16(2)21(11-15)31-24-18(7-6-10-25-24)23(27)26-14-17-12-19(28-3)22(30-5)20(13-17)29-4/h6-13H,14H2,1-5H3,(H,26,27)