N-[1-ethyl-2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]benzimidazol-5-yl]propanamide

Systemtic Name: N-[1-ethyl-2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]benzimidazol-5-yl]propanamide Openeye Name: N-[1-ethyl-2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]benzimidazol-5-yl]propanamide CAS Name: N-[1-ethyl-2-[[(4-methyl-2-pyrimidinyl)thio]methyl]-5-benzimidazolyl]propanamide IUPAC Name: N-[1-ethyl-2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]benzimidazol-5-yl]propanamide Traditional Name: N-[1-ethyl-2-[[(4-methylpyrimidin-2-yl)thio]methyl]benzimidazol-5-yl]propionamide Formula: C18H21N5OS MolecularWeight: 355.45724

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC2=C(C=C1)N(C(=N2)CSC3=NC=CC(=N3)C)CC

Isomeric SMILES

CCC(=O)NC1=CC2=C(C=C1)N(C(=N2)CSC3=NC=CC(=N3)C)CC

InChI

InChI=1S/C18H21N5OS/c1-4-17(24)21-13-6-7-15-14(10-13)22-16(23(15)5-2)11-25-18-19-9-8-12(3)20-18/h6-10H,4-5,11H2,1-3H3,(H,21,24)