2-[4-(4-ethylsulfonylphenyl)piperazin-1-yl]-3a,4,5,6-tetrahydro-1H-perimidine

Systemtic Name: 2-[4-(4-ethylsulfonylphenyl)piperazin-1-yl]-3a,4,5,6-tetrahydro-1H-perimidine Openeye Name: 2-[4-(4-ethylsulfonylphenyl)piperazin-1-yl]-3a,4,5,6-tetrahydro-1H-perimidine CAS Name: 2-[4-(4-ethylsulfonylphenyl)-1-piperazinyl]-3a,4,5,6-tetrahydro-1H-perimidine IUPAC Name: 2-[4-(4-ethylsulfonylphenyl)piperazin-1-yl]-3a,4,5,6-tetrahydro-1H-perimidine Traditional Name: 2-[4-(4-esylphenyl)piperazino]-3a,4,5,6-tetrahydro-1H-perimidine Formula: C23H28N4O2S MolecularWeight: 424.55902

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=C(C=C1)N2CCN(CC2)C3=NC4CCCC5=C4C(=CC=C5)N3

Isomeric SMILES

CCS(=O)(=O)C1=CC=C(C=C1)N2CCN(CC2)C3=NC4CCCC5=C4C(=CC=C5)N3

InChI

InChI=1S/C23H28N4O2S/c1-2-30(28,29)19-11-9-18(10-12-19)26-13-15-27(16-14-26)23-24-20-7-3-5-17-6-4-8-21(25-23)22(17)20/h3,5,7,9-12,21H,2,4,6,8,13-16H2,1H3,(H,24,25)