2-(2,5-dimethylphenyl)sulfanyl-N-methyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]pyridine-3-carboxamide

Systemtic Name: 2-(2,5-dimethylphenyl)sulfanyl-N-methyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]pyridine-3-carboxamide Openeye Name: 2-(2,5-dimethylphenyl)sulfanyl-N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]pyridine-3-carboxamide CAS Name: 2-[(2,5-dimethylphenyl)thio]-N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-3-pyridinecarboxamide IUPAC Name: 2-(2,5-dimethylphenyl)sulfanyl-N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]pyridine-3-carboxamide Traditional Name: 2-[(2,5-dimethylphenyl)thio]-N-[(4-keto-1H-quinazolin-2-yl)methyl]-N-methyl-nicotinamide Formula: C24H22N4O2S MolecularWeight: 430.52208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SC2=C(C=CC=N2)C(=O)N(C)CC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CC1=CC(=C(C=C1)C)SC2=C(C=CC=N2)C(=O)N(C)CC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C24H22N4O2S/c1-15-10-11-16(2)20(13-15)31-23-18(8-6-12-25-23)24(30)28(3)14-21-26-19-9-5-4-7-17(19)22(29)27-21/h4-13H,14H2,1-3H3,(H,26,27,29)