5-azanyl-N-(4-methylphenyl)-2-morpholin-4-yl-4-(phenylmethylsulfanyl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 5-azanyl-N-(4-methylphenyl)-2-morpholin-4-yl-4-(phenylmethylsulfanyl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 5-amino-4-benzylsulfanyl-2-morpholino-N-(p-tolyl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 5-amino-N-(4-methylphenyl)-2-(4-morpholinyl)-4-(phenylmethylthio)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 5-amino-4-benzylsulfanyl-N-(4-methylphenyl)-2-morpholin-4-ylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 5-amino-4-(benzylthio)-2-morpholino-N-(p-tolyl)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C25H25N5O2S2 MolecularWeight: 491.6283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=C(C3=C(S2)N=C(N=C3SCC4=CC=CC=C4)N5CCOCC5)N

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=C(C3=C(S2)N=C(N=C3SCC4=CC=CC=C4)N5CCOCC5)N

InChI

InChI=1S/C25H25N5O2S2/c1-16-7-9-18(10-8-16)27-22(31)21-20(26)19-23(33-15-17-5-3-2-4-6-17)28-25(29-24(19)34-21)30-11-13-32-14-12-30/h2-10H,11-15,26H2,1H3,(H,27,31)