[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-[3-(2-chlorophenyl)-1H-pyrazol-5-yl]methanone

Systemtic Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-[3-(2-chlorophenyl)-1H-pyrazol-5-yl]methanone Openeye Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-[3-(2-chlorophenyl)-1H-pyrazol-5-yl]methanone CAS Name: [4-(1-azepanylsulfonyl)-1-piperazinyl]-[3-(2-chlorophenyl)-1H-pyrazol-5-yl]methanone IUPAC Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-[3-(2-chlorophenyl)-1H-pyrazol-5-yl]methanone Traditional Name: [4-(azepan-1-ylsulfonyl)piperazino]-[3-(2-chlorophenyl)-1H-pyrazol-5-yl]methanone Formula: C20H26ClN5O3S MolecularWeight: 451.97014

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=NN3)C4=CC=CC=C4Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=NN3)C4=CC=CC=C4Cl

InChI

InChI=1S/C20H26ClN5O3S/c21-17-8-4-3-7-16(17)18-15-19(23-22-18)20(27)24-11-13-26(14-12-24)30(28,29)25-9-5-1-2-6-10-25/h3-4,7-8,15H,1-2,5-6,9-14H2,(H,22,23)