3-(1-methyl-5-pyrrolidin-1-ylsulfonyl-benzimidazol-2-yl)propanoate

Systemtic Name: 3-(1-methyl-5-pyrrolidin-1-ylsulfonyl-benzimidazol-2-yl)propanoate Openeye Name: 3-(1-methyl-5-pyrrolidin-1-ylsulfonyl-benzimidazol-2-yl)propanoate CAS Name: 3-[1-methyl-5-(1-pyrrolidinylsulfonyl)-2-benzimidazolyl]propanoate IUPAC Name: 3-(1-methyl-5-pyrrolidin-1-ylsulfonylbenzimidazol-2-yl)propanoate Traditional Name: 3-(1-methyl-5-pyrrolidinosulfonyl-benzimidazol-2-yl)propionate Formula: C15H18N3O4S- MolecularWeight: 336.38612

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)N=C1CCC(=O)[O-]

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)N=C1CCC(=O)[O-]

InChI

InChI=1S/C15H19N3O4S/c1-17-13-5-4-11(23(21,22)18-8-2-3-9-18)10-12(13)16-14(17)6-7-15(19)20/h4-5,10H,2-3,6-9H2,1H3,(H,19,20)/p-1