N-[3-(benzimidazol-1-yl)propyl]-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanamide

Systemtic Name: N-[3-(benzimidazol-1-yl)propyl]-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanamide Openeye Name: N-[3-(benzimidazol-1-yl)propyl]-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanamide CAS Name: N-[3-(1-benzimidazolyl)propyl]-3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]propanamide IUPAC Name: N-[3-(benzimidazol-1-yl)propyl]-3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanamide Traditional Name: N-[3-(benzimidazol-1-yl)propyl]-3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]propionamide Formula: C20H25N5OS MolecularWeight: 383.5104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NCCCN2C=NC3=CC=CC=C32

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NCCCN2C=NC3=CC=CC=C32

InChI

InChI=1S/C20H25N5OS/c1-14-16(15(2)24-20(23-14)27-3)9-10-19(26)21-11-6-12-25-13-22-17-7-4-5-8-18(17)25/h4-5,7-8,13H,6,9-12H2,1-3H3,(H,21,26)