4-[(1-methyl-5-pyrrolidin-1-ylsulfonyl-benzimidazol-2-yl)methyl]benzenecarboximidamide

Systemtic Name: 4-[(1-methyl-5-pyrrolidin-1-ylsulfonyl-benzimidazol-2-yl)methyl]benzenecarboximidamide Openeye Name: 4-[(1-methyl-5-pyrrolidin-1-ylsulfonyl-benzimidazol-2-yl)methyl]benzamidine CAS Name: 4-[[1-methyl-5-(1-pyrrolidinylsulfonyl)-2-benzimidazolyl]methyl]benzenecarboximidamide IUPAC Name: 4-[(1-methyl-5-pyrrolidin-1-ylsulfonylbenzimidazol-2-yl)methyl]benzenecarboximidamide Traditional Name: 4-[(1-methyl-5-pyrrolidinosulfonyl-benzimidazol-2-yl)methyl]benzamidine Formula: C20H23N5O2S MolecularWeight: 397.49392

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)N=C1CC4=CC=C(C=C4)C(=N)N

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)N=C1CC4=CC=C(C=C4)C(=N)N

InChI

InChI=1S/C20H23N5O2S/c1-24-18-9-8-16(28(26,27)25-10-2-3-11-25)13-17(18)23-19(24)12-14-4-6-15(7-5-14)20(21)22/h4-9,13H,2-3,10-12H2,1H3,(H3,21,22)