6-methyl-5-(4-methylphenyl)-2-[[(4-methylphenyl)amino]methyl]-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 6-methyl-5-(4-methylphenyl)-2-[[(4-methylphenyl)amino]methyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 6-methyl-2-[(4-methylanilino)methyl]-5-(p-tolyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 6-methyl-2-[(4-methylanilino)methyl]-5-(4-methylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 6-methyl-2-[(4-methylanilino)methyl]-5-(4-methylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 6-methyl-2-(p-toluidinomethyl)-5-(p-tolyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C22H21N3OS MolecularWeight: 375.48664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC3=C2C(=O)NC(=N3)CNC4=CC=C(C=C4)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC3=C2C(=O)NC(=N3)CNC4=CC=C(C=C4)C)C

InChI

InChI=1S/C22H21N3OS/c1-13-4-8-16(9-5-13)19-15(3)27-22-20(19)21(26)24-18(25-22)12-23-17-10-6-14(2)7-11-17/h4-11,23H,12H2,1-3H3,(H,24,25,26)