N-[2-(1-hexylbenzimidazol-2-yl)sulfanylethanoyl]-1-methyl-pyrrole-2-carboxamide

Systemtic Name: N-[2-(1-hexylbenzimidazol-2-yl)sulfanylethanoyl]-1-methyl-pyrrole-2-carboxamide Openeye Name: N-[2-(1-hexylbenzimidazol-2-yl)sulfanylacetyl]-1-methyl-pyrrole-2-carboxamide CAS Name: N-[2-[(1-hexyl-2-benzimidazolyl)thio]-1-oxoethyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: N-[2-(1-hexylbenzimidazol-2-yl)sulfanylacetyl]-1-methylpyrrole-2-carboxamide Traditional Name: N-[2-[(1-hexylbenzimidazol-2-yl)thio]acetyl]-1-methyl-pyrrole-2-carboxamide Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=CC=CC=C2N=C1SCC(=O)NC(=O)C3=CC=CN3C

Isomeric SMILES

CCCCCCN1C2=CC=CC=C2N=C1SCC(=O)NC(=O)C3=CC=CN3C

InChI

InChI=1S/C21H26N4O2S/c1-3-4-5-8-14-25-17-11-7-6-10-16(17)22-21(25)28-15-19(26)23-20(27)18-12-9-13-24(18)2/h6-7,9-13H,3-5,8,14-15H2,1-2H3,(H,23,26,27)