4-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-2,6-dipyrrolidin-1-yl-1,3,5-triazin-1-ium

Systemtic Name: 4-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-2,6-dipyrrolidin-1-yl-1,3,5-triazin-1-ium Openeye Name: 4-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-2,6-dipyrrolidin-1-yl-1,3,5-triazin-1-ium CAS Name: 4-[4-(4-methoxyphenyl)sulfonyl-1-piperazinyl]-2,6-bis(1-pyrrolidinyl)-1,3,5-triazin-1-ium IUPAC Name: 4-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-2,6-dipyrrolidin-1-yl-1,3,5-triazin-1-ium Traditional Name: 4-[4-(4-methoxyphenyl)sulfonylpiperazino]-2,6-dipyrrolidino-s-triazin-1-ium Formula: C22H32N7O3S+ MolecularWeight: 474.59958

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC(=[NH+]C(=N3)N4CCCC4)N5CCCC5

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC(=[NH+]C(=N3)N4CCCC4)N5CCCC5

InChI

InChI=1S/C22H31N7O3S/c1-32-18-6-8-19(9-7-18)33(30,31)29-16-14-28(15-17-29)22-24-20(26-10-2-3-11-26)23-21(25-22)27-12-4-5-13-27/h6-9H,2-5,10-17H2,1H3/p+1