4-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-5-chloranyl-1H-pyridazin-6-one

Systemtic Name: 4-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-5-chloranyl-1H-pyridazin-6-one Openeye Name: 4-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-5-chloro-1H-pyridazin-6-one CAS Name: 4-[4-(1-azepanylsulfonyl)-1-piperazinyl]-5-chloro-1H-pyridazin-6-one IUPAC Name: 4-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-5-chloro-1H-pyridazin-6-one Traditional Name: 4-[4-(azepan-1-ylsulfonyl)piperazino]-5-chloro-1H-pyridazin-6-one Formula: C14H22ClN5O3S MolecularWeight: 375.87418

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C3=C(C(=O)NN=C3)Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C3=C(C(=O)NN=C3)Cl

InChI

InChI=1S/C14H22ClN5O3S/c15-13-12(11-16-17-14(13)21)18-7-9-20(10-8-18)24(22,23)19-5-3-1-2-4-6-19/h11H,1-10H2,(H,17,21)