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

Systemtic Name: 5-methyl-3-[(3-methylphenyl)methyl]-4-oxidanylidene-N-phenyl-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 5-methyl-3-(m-tolylmethyl)-4-oxo-N-phenyl-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 5-methyl-3-[(3-methylphenyl)methyl]-4-oxo-N-phenyl-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 5-methyl-3-[(3-methylphenyl)methyl]-4-oxo-N-phenylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 4-keto-5-methyl-3-(3-methylbenzyl)-N-phenyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C22H19N3O2S MolecularWeight: 389.47016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C=NC3=C(C2=O)C(=C(S3)C(=O)NC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=CC=C1)CN2C=NC3=C(C2=O)C(=C(S3)C(=O)NC4=CC=CC=C4)C

InChI

InChI=1S/C22H19N3O2S/c1-14-7-6-8-16(11-14)12-25-13-23-21-18(22(25)27)15(2)19(28-21)20(26)24-17-9-4-3-5-10-17/h3-11,13H,12H2,1-2H3,(H,24,26)