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

Systemtic Name: 6-methyl-2-[[(4-methylphenyl)amino]methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 6-methyl-2-[(4-methylanilino)methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 6-methyl-2-[(4-methylanilino)methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 6-methyl-2-[(4-methylanilino)methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 6-methyl-5-phenyl-2-(p-toluidinomethyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C21H19N3OS MolecularWeight: 361.46006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NCC2=NC3=C(C(=C(S3)C)C4=CC=CC=C4)C(=O)N2

Isomeric SMILES

CC1=CC=C(C=C1)NCC2=NC3=C(C(=C(S3)C)C4=CC=CC=C4)C(=O)N2

InChI

InChI=1S/C21H19N3OS/c1-13-8-10-16(11-9-13)22-12-17-23-20(25)19-18(14(2)26-21(19)24-17)15-6-4-3-5-7-15/h3-11,22H,12H2,1-2H3,(H,23,24,25)