N-(2-imidazol-1-ylethyl)-3-[(2-methylphenyl)methylamino]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(2-imidazol-1-ylethyl)-3-[(2-methylphenyl)methylamino]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(2-imidazol-1-ylethyl)-3-(o-tolylmethylamino)-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[2-(1-imidazolyl)ethyl]-3-[(2-methylphenyl)methylamino]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(2-imidazol-1-ylethyl)-3-[(2-methylphenyl)methylamino]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(2-imidazol-1-ylethyl)-3-[(2-methylbenzyl)amino]-5-pyrrolidinosulfonyl-benzamide Formula: C24H29N5O3S MolecularWeight: 467.58376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC2=CC(=CC(=C2)C(=O)NCCN3C=CN=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=CC=CC=C1CNC2=CC(=CC(=C2)C(=O)NCCN3C=CN=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C24H29N5O3S/c1-19-6-2-3-7-20(19)17-27-22-14-21(24(30)26-9-13-28-12-8-25-18-28)15-23(16-22)33(31,32)29-10-4-5-11-29/h2-3,6-8,12,14-16,18,27H,4-5,9-11,13,17H2,1H3,(H,26,30)