N-(2-diethylaminoethyl)-5-methyl-4-[methyl(phenyl)amino]thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-(2-diethylaminoethyl)-5-methyl-4-[methyl(phenyl)amino]thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(2-diethylaminoethyl)-5-methyl-4-(N-methylanilino)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(2-diethylaminoethyl)-5-methyl-4-(N-methylanilino)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(2-diethylaminoethyl)-5-methyl-4-(N-methylanilino)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(2-diethylaminoethyl)-5-methyl-4-(N-methylanilino)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C21H27N5OS MolecularWeight: 397.53698

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=C(C2=C(N=CN=C2S1)N(C)C3=CC=CC=C3)C

Isomeric SMILES

CCN(CC)CCNC(=O)C1=C(C2=C(N=CN=C2S1)N(C)C3=CC=CC=C3)C

InChI

InChI=1S/C21H27N5OS/c1-5-26(6-2)13-12-22-20(27)18-15(3)17-19(23-14-24-21(17)28-18)25(4)16-10-8-7-9-11-16/h7-11,14H,5-6,12-13H2,1-4H3,(H,22,27)