cyclopropyl-[2-oxidanylidene-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethyl]-[(4-propan-2-ylphenyl)methyl]azanium

Systemtic Name: cyclopropyl-[2-oxidanylidene-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethyl]-[(4-propan-2-ylphenyl)methyl]azanium Openeye Name: cyclopropyl-[(4-isopropylphenyl)methyl]-[2-oxo-2-[4-(2-thienylsulfonyl)piperazin-1-yl]ethyl]ammonium CAS Name: cyclopropyl-[2-oxo-2-(4-thiophen-2-ylsulfonyl-1-piperazinyl)ethyl]-[(4-propan-2-ylphenyl)methyl]ammonium IUPAC Name: cyclopropyl-[2-oxo-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethyl]-[(4-propan-2-ylphenyl)methyl]azanium Traditional Name: cyclopropyl-(4-isopropylbenzyl)-[2-keto-2-[4-(2-thienylsulfonyl)piperazino]ethyl]ammonium Formula: C23H32N3O3S2+ MolecularWeight: 462.64848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C[NH+](CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CS3)C4CC4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C[NH+](CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CS3)C4CC4

InChI

InChI=1S/C23H31N3O3S2/c1-18(2)20-7-5-19(6-8-20)16-25(21-9-10-21)17-22(27)24-11-13-26(14-12-24)31(28,29)23-4-3-15-30-23/h3-8,15,18,21H,9-14,16-17H2,1-2H3/p+1