4-(azepan-1-ylcarbonyl)-1,2,5-trimethyl-N-(phenylmethyl)-N-propan-2-yl-pyrrole-3-sulfonamide

Systemtic Name: 4-(azepan-1-ylcarbonyl)-1,2,5-trimethyl-N-(phenylmethyl)-N-propan-2-yl-pyrrole-3-sulfonamide Openeye Name: 4-(azepane-1-carbonyl)-N-benzyl-N-isopropyl-1,2,5-trimethyl-pyrrole-3-sulfonamide CAS Name: 4-[1-azepanyl(oxo)methyl]-1,2,5-trimethyl-N-(phenylmethyl)-N-propan-2-yl-3-pyrrolesulfonamide IUPAC Name: 4-(azepane-1-carbonyl)-N-benzyl-1,2,5-trimethyl-N-propan-2-ylpyrrole-3-sulfonamide Traditional Name: 4-(azepane-1-carbonyl)-N-benzyl-N-isopropyl-1,2,5-trimethyl-pyrrole-3-sulfonamide Formula: C24H35N3O3S MolecularWeight: 445.618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1C)C)S(=O)(=O)N(CC2=CC=CC=C2)C(C)C)C(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C(=C(N1C)C)S(=O)(=O)N(CC2=CC=CC=C2)C(C)C)C(=O)N3CCCCCC3

InChI

InChI=1S/C24H35N3O3S/c1-18(2)27(17-21-13-9-8-10-14-21)31(29,30)23-20(4)25(5)19(3)22(23)24(28)26-15-11-6-7-12-16-26/h8-10,13-14,18H,6-7,11-12,15-17H2,1-5H3