N-(4-chlorophenyl)-5-methyl-4-oxidanylidene-3-(phenylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-(4-chlorophenyl)-5-methyl-4-oxidanylidene-3-(phenylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 3-benzyl-N-(4-chlorophenyl)-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(4-chlorophenyl)-5-methyl-4-oxo-3-(phenylmethyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 3-benzyl-N-(4-chlorophenyl)-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 3-benzyl-N-(4-chlorophenyl)-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C21H16ClN3O2S MolecularWeight: 409.88864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H16ClN3O2S/c1-13-17-20(23-12-25(21(17)27)11-14-5-3-2-4-6-14)28-18(13)19(26)24-16-9-7-15(22)8-10-16/h2-10,12H,11H2,1H3,(H,24,26)