5-azanyl-1-[(4-methoxyphenyl)methyl]-2-methylsulfanyl-4-phenyl-7aH-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 5-azanyl-1-[(4-methoxyphenyl)methyl]-2-methylsulfanyl-4-phenyl-7aH-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 5-amino-1-[(4-methoxyphenyl)methyl]-2-methylsulfanyl-4-phenyl-7aH-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 5-amino-1-[(4-methoxyphenyl)methyl]-2-(methylthio)-4-phenyl-7aH-thieno[2,3-d]pyrimidine-6-carboxamide IUPAC Name: 5-amino-1-[(4-methoxyphenyl)methyl]-2-methylsulfanyl-4-phenyl-7aH-thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 5-amino-2-(methylthio)-1-p-anisyl-4-phenyl-7aH-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C22H22N4O2S2 MolecularWeight: 438.56568

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C3C(=C(N=C2SC)C4=CC=CC=C4)C(=C(S3)C(=O)N)N

Isomeric SMILES

COC1=CC=C(C=C1)CN2C3C(=C(N=C2SC)C4=CC=CC=C4)C(=C(S3)C(=O)N)N

InChI

InChI=1S/C22H22N4O2S2/c1-28-15-10-8-13(9-11-15)12-26-21-16(17(23)19(30-21)20(24)27)18(25-22(26)29-2)14-6-4-3-5-7-14/h3-11,21H,12,23H2,1-2H3,(H2,24,27)