N-(1H-benzimidazol-2-yl)-1-methyl-4-piperidin-1-ylsulfonyl-pyrrole-2-carboxamide

Systemtic Name: N-(1H-benzimidazol-2-yl)-1-methyl-4-piperidin-1-ylsulfonyl-pyrrole-2-carboxamide Openeye Name: N-(1H-benzimidazol-2-yl)-1-methyl-4-(1-piperidylsulfonyl)pyrrole-2-carboxamide CAS Name: N-(1H-benzimidazol-2-yl)-1-methyl-4-(1-piperidinylsulfonyl)-2-pyrrolecarboxamide IUPAC Name: N-(1H-benzimidazol-2-yl)-1-methyl-4-piperidin-1-ylsulfonylpyrrole-2-carboxamide Traditional Name: N-(1H-benzimidazol-2-yl)-1-methyl-4-piperidinosulfonyl-pyrrole-2-carboxamide Formula: C18H21N5O3S MolecularWeight: 387.45604

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NC2=NC3=CC=CC=C3N2)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CN1C=C(C=C1C(=O)NC2=NC3=CC=CC=C3N2)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C18H21N5O3S/c1-22-12-13(27(25,26)23-9-5-2-6-10-23)11-16(22)17(24)21-18-19-14-7-3-4-8-15(14)20-18/h3-4,7-8,11-12H,2,5-6,9-10H2,1H3,(H2,19,20,21,24)