[(4S)-4-[2,5-dimethyl-3-[(4-methylphenyl)sulfonylcarbamoyl]pyrrol-1-yl]pentyl]-diethyl-azanium

Systemtic Name: [(4S)-4-[2,5-dimethyl-3-[(4-methylphenyl)sulfonylcarbamoyl]pyrrol-1-yl]pentyl]-diethyl-azanium Openeye Name: [(4S)-4-[2,5-dimethyl-3-(p-tolylsulfonylcarbamoyl)pyrrol-1-yl]pentyl]-diethyl-ammonium CAS Name: [(4S)-4-[2,5-dimethyl-3-[[(4-methylphenyl)sulfonylamino]-oxomethyl]-1-pyrrolyl]pentyl]-diethylammonium IUPAC Name: [(4S)-4-[2,5-dimethyl-3-[(4-methylphenyl)sulfonylcarbamoyl]pyrrol-1-yl]pentyl]-diethylazanium Traditional Name: [(4S)-4-[2,5-dimethyl-3-(tosylcarbamoyl)pyrrol-1-yl]pentyl]-diethyl-ammonium Formula: C23H36N3O3S+ MolecularWeight: 434.61524

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCC(C)N1C(=CC(=C1C)C(=O)NS(=O)(=O)C2=CC=C(C=C2)C)C

Isomeric SMILES

CC[NH+](CC)CCC[C@H](C)N1C(=CC(=C1C)C(=O)NS(=O)(=O)C2=CC=C(C=C2)C)C

InChI

InChI=1S/C23H35N3O3S/c1-7-25(8-2)15-9-10-18(4)26-19(5)16-22(20(26)6)23(27)24-30(28,29)21-13-11-17(3)12-14-21/h11-14,16,18H,7-10,15H2,1-6H3,(H,24,27)/p+1/t18-/m0/s1