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

Systemtic Name: 2-[[(4-ethoxy-3-methoxy-phenyl)amino]methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(4-ethoxy-3-methoxy-anilino)methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(4-ethoxy-3-methoxyanilino)methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(4-ethoxy-3-methoxyanilino)methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(4-ethoxy-3-methoxy-anilino)methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C22H21N3O3S MolecularWeight: 407.48544

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C22H21N3O3S/c1-3-28-17-10-9-15(11-18(17)27-2)23-13-20-24-21(26)16-12-19(29-22(16)25-20)14-7-5-4-6-8-14/h4-12,23H,3,13H2,1-2H3,(H,24,25,26)