N-(4-ethylphenyl)-5-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-(4-ethylphenyl)-5-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(4-ethylphenyl)-5-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(4-ethylphenyl)-5-methyl-4-(4-methyl-1-piperazinyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(4-ethylphenyl)-5-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(4-ethylphenyl)-5-methyl-4-(4-methylpiperazino)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C21H25N5OS MolecularWeight: 395.5211

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C2=C(C3=C(N=CN=C3S2)N4CCN(CC4)C)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C2=C(C3=C(N=CN=C3S2)N4CCN(CC4)C)C

InChI

InChI=1S/C21H25N5OS/c1-4-15-5-7-16(8-6-15)24-20(27)18-14(2)17-19(22-13-23-21(17)28-18)26-11-9-25(3)10-12-26/h5-8,13H,4,9-12H2,1-3H3,(H,24,27)