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

Systemtic Name: 5-(4-methoxyphenyl)-2-[[(4-methylphenyl)amino]methyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(4-methoxyphenyl)-2-[(4-methylanilino)methyl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-methoxyphenyl)-2-[(4-methylanilino)methyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5-(4-methoxyphenyl)-2-[(4-methylanilino)methyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(4-methoxyphenyl)-2-(p-toluidinomethyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NCC2=NC3=C(C(=CS3)C4=CC=C(C=C4)OC)C(=O)N2

Isomeric SMILES

CC1=CC=C(C=C1)NCC2=NC3=C(C(=CS3)C4=CC=C(C=C4)OC)C(=O)N2

InChI

InChI=1S/C21H19N3O2S/c1-13-3-7-15(8-4-13)22-11-18-23-20(25)19-17(12-27-21(19)24-18)14-5-9-16(26-2)10-6-14/h3-10,12,22H,11H2,1-2H3,(H,23,24,25)