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

Systemtic Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2,4,5-trimethyl-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2,4,5-trimethyl-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2,4,5-trimethyl-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-2,4,5-trimethylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2,4,5-trimethyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C21H23N5OS2 MolecularWeight: 425.57022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)C)C)C(=O)NC(CCSC)C3=NC4=CC=CC=C4N3

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)C)C)C(=O)NC(CCSC)C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C21H23N5OS2/c1-11-17-12(2)22-13(3)23-21(17)29-18(11)20(27)26-16(9-10-28-4)19-24-14-7-5-6-8-15(14)25-19/h5-8,16H,9-10H2,1-4H3,(H,24,25)(H,26,27)