2-(3,4-dimethylphenyl)sulfanyl-N-methyl-N-[(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]pyridine-3-carboxamide

Systemtic Name: 2-(3,4-dimethylphenyl)sulfanyl-N-methyl-N-[(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]pyridine-3-carboxamide Openeye Name: 2-(3,4-dimethylphenyl)sulfanyl-N-methyl-N-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]pyridine-3-carboxamide CAS Name: 2-[(3,4-dimethylphenyl)thio]-N-methyl-N-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]-3-pyridinecarboxamide IUPAC Name: 2-(3,4-dimethylphenyl)sulfanyl-N-methyl-N-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]pyridine-3-carboxamide Traditional Name: 2-[(3,4-dimethylphenyl)thio]-N-[(4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]-N-methyl-nicotinamide Formula: C22H20N4O2S2 MolecularWeight: 436.5498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SC2=C(C=CC=N2)C(=O)N(C)CC3=NC(=O)C4=C(N3)C=CS4)C

Isomeric SMILES

CC1=C(C=C(C=C1)SC2=C(C=CC=N2)C(=O)N(C)CC3=NC(=O)C4=C(N3)C=CS4)C

InChI

InChI=1S/C22H20N4O2S2/c1-13-6-7-15(11-14(13)2)30-21-16(5-4-9-23-21)22(28)26(3)12-18-24-17-8-10-29-19(17)20(27)25-18/h4-11H,12H2,1-3H3,(H,24,25,27)