N-(3-methylphenyl)-2-[4-oxidanylidene-3-(pyridin-2-ylmethyl)thieno[3,2-d]pyrimidin-2-yl]sulfanyl-butanamide

Systemtic Name: N-(3-methylphenyl)-2-[4-oxidanylidene-3-(pyridin-2-ylmethyl)thieno[3,2-d]pyrimidin-2-yl]sulfanyl-butanamide Openeye Name: N-(m-tolyl)-2-[4-oxo-3-(2-pyridylmethyl)thieno[3,2-d]pyrimidin-2-yl]sulfanyl-butanamide CAS Name: N-(3-methylphenyl)-2-[[4-oxo-3-(2-pyridinylmethyl)-2-thieno[3,2-d]pyrimidinyl]thio]butanamide IUPAC Name: N-(3-methylphenyl)-2-[4-oxo-3-(pyridin-2-ylmethyl)thieno[3,2-d]pyrimidin-2-yl]sulfanylbutanamide Traditional Name: 2-[[4-keto-3-(2-pyridylmethyl)thieno[3,2-d]pyrimidin-2-yl]thio]-N-(m-tolyl)butyramide Formula: C23H22N4O2S2 MolecularWeight: 450.57638

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC(=C1)C)SC2=NC3=C(C(=O)N2CC4=CC=CC=N4)SC=C3

Isomeric SMILES

CCC(C(=O)NC1=CC=CC(=C1)C)SC2=NC3=C(C(=O)N2CC4=CC=CC=N4)SC=C3

InChI

InChI=1S/C23H22N4O2S2/c1-3-19(21(28)25-16-9-6-7-15(2)13-16)31-23-26-18-10-12-30-20(18)22(29)27(23)14-17-8-4-5-11-24-17/h4-13,19H,3,14H2,1-2H3,(H,25,28)