N-[3-(benzimidazol-1-yl)propyl]-2-ethyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-[3-(benzimidazol-1-yl)propyl]-2-ethyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-[3-(benzimidazol-1-yl)propyl]-2-ethyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-[3-(1-benzimidazolyl)propyl]-2-ethyl-4,5-dimethyl-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-[3-(benzimidazol-1-yl)propyl]-2-ethyl-4,5-dimethylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-[3-(benzimidazol-1-yl)propyl]-2-ethyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C21H23N5OS MolecularWeight: 393.50522

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C2C(=C(SC2=N1)C(=O)NCCCN3C=NC4=CC=CC=C43)C)C

Isomeric SMILES

CCC1=NC(=C2C(=C(SC2=N1)C(=O)NCCCN3C=NC4=CC=CC=C43)C)C

InChI

InChI=1S/C21H23N5OS/c1-4-17-24-14(3)18-13(2)19(28-21(18)25-17)20(27)22-10-7-11-26-12-23-15-8-5-6-9-16(15)26/h5-6,8-9,12H,4,7,10-11H2,1-3H3,(H,22,27)