N-[2-[(2,5-dimethylphenyl)methylsulfanyl]-4-oxidanylidene-thieno[3,2-d]pyrimidin-3-yl]benzamide

Systemtic Name: N-[2-[(2,5-dimethylphenyl)methylsulfanyl]-4-oxidanylidene-thieno[3,2-d]pyrimidin-3-yl]benzamide Openeye Name: N-[2-[(2,5-dimethylphenyl)methylsulfanyl]-4-oxo-thieno[3,2-d]pyrimidin-3-yl]benzamide CAS Name: N-[2-[(2,5-dimethylphenyl)methylthio]-4-oxo-3-thieno[3,2-d]pyrimidinyl]benzamide IUPAC Name: N-[2-[(2,5-dimethylphenyl)methylsulfanyl]-4-oxothieno[3,2-d]pyrimidin-3-yl]benzamide Traditional Name: N-[2-[(2,5-dimethylbenzyl)thio]-4-keto-thieno[3,2-d]pyrimidin-3-yl]benzamide Formula: C22H19N3O2S2 MolecularWeight: 421.53516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CSC2=NC3=C(C(=O)N2NC(=O)C4=CC=CC=C4)SC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)CSC2=NC3=C(C(=O)N2NC(=O)C4=CC=CC=C4)SC=C3

InChI

InChI=1S/C22H19N3O2S2/c1-14-8-9-15(2)17(12-14)13-29-22-23-18-10-11-28-19(18)21(27)25(22)24-20(26)16-6-4-3-5-7-16/h3-12H,13H2,1-2H3,(H,24,26)