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

Systemtic Name: 4-(azepan-1-yl)-5-methyl-N-(1-phenylethyl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 4-(azepan-1-yl)-5-methyl-N-(1-phenylethyl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 4-(1-azepanyl)-5-methyl-N-(1-phenylethyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 4-(azepan-1-yl)-5-methyl-N-(1-phenylethyl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 4-(azepan-1-yl)-5-methyl-N-(1-phenylethyl)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C22H26N4OS MolecularWeight: 394.53304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)N3CCCCCC3)C(=O)NC(C)C4=CC=CC=C4

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)N3CCCCCC3)C(=O)NC(C)C4=CC=CC=C4

InChI

InChI=1S/C22H26N4OS/c1-15-18-20(26-12-8-3-4-9-13-26)23-14-24-22(18)28-19(15)21(27)25-16(2)17-10-6-5-7-11-17/h5-7,10-11,14,16H,3-4,8-9,12-13H2,1-2H3,(H,25,27)