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

Systemtic Name: N-butan-2-yl-5-methyl-4-[methyl(phenyl)amino]thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 5-methyl-4-(N-methylanilino)-N-sec-butyl-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-butan-2-yl-5-methyl-4-(N-methylanilino)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-butan-2-yl-5-methyl-4-(N-methylanilino)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 5-methyl-4-(N-methylanilino)-N-sec-butyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C19H22N4OS MolecularWeight: 354.46918

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=C(C2=C(N=CN=C2S1)N(C)C3=CC=CC=C3)C

Isomeric SMILES

CCC(C)NC(=O)C1=C(C2=C(N=CN=C2S1)N(C)C3=CC=CC=C3)C

InChI

InChI=1S/C19H22N4OS/c1-5-12(2)22-18(24)16-13(3)15-17(20-11-21-19(15)25-16)23(4)14-9-7-6-8-10-14/h6-12H,5H2,1-4H3,(H,22,24)