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

Systemtic Name: N-(4-ethoxyphenyl)-5-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(4-ethoxyphenyl)-5-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(4-ethoxyphenyl)-5-methyl-4-(4-methyl-1-piperazinyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(4-ethoxyphenyl)-5-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 5-methyl-4-(4-methylpiperazino)-N-p-phenetyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C21H25N5O2S MolecularWeight: 411.5205

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=C(C3=C(N=CN=C3S2)N4CCN(CC4)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=C(C3=C(N=CN=C3S2)N4CCN(CC4)C)C

InChI

InChI=1S/C21H25N5O2S/c1-4-28-16-7-5-15(6-8-16)24-20(27)18-14(2)17-19(22-13-23-21(17)29-18)26-11-9-25(3)10-12-26/h5-8,13H,4,9-12H2,1-3H3,(H,24,27)