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

Systemtic Name: 2-[[(3,4-diethoxyphenyl)amino]methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(3,4-diethoxyanilino)methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(3,4-diethoxyanilino)methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(3,4-diethoxyanilino)methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(3,4-diethoxyanilino)methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C23H23N3O3S MolecularWeight: 421.51202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NCC2=NC3=C(C=C(S3)C4=CC=CC=C4)C(=O)N2)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NCC2=NC3=C(C=C(S3)C4=CC=CC=C4)C(=O)N2)OCC

InChI

InChI=1S/C23H23N3O3S/c1-3-28-18-11-10-16(12-19(18)29-4-2)24-14-21-25-22(27)17-13-20(30-23(17)26-21)15-8-6-5-7-9-15/h5-13,24H,3-4,14H2,1-2H3,(H,25,26,27)