[4-(azepan-1-ylsulfonyl)phenyl]-(4-pyridin-4-ylpiperazin-1-yl)methanone

Systemtic Name: [4-(azepan-1-ylsulfonyl)phenyl]-(4-pyridin-4-ylpiperazin-1-yl)methanone Openeye Name: [4-(azepan-1-ylsulfonyl)phenyl]-[4-(4-pyridyl)piperazin-1-yl]methanone CAS Name: [4-(1-azepanylsulfonyl)phenyl]-(4-pyridin-4-yl-1-piperazinyl)methanone IUPAC Name: [4-(azepan-1-ylsulfonyl)phenyl]-(4-pyridin-4-ylpiperazin-1-yl)methanone Traditional Name: [4-(azepan-1-ylsulfonyl)phenyl]-[4-(4-pyridyl)piperazino]methanone Formula: C22H28N4O3S MolecularWeight: 428.54772

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=NC=C4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=NC=C4

InChI

InChI=1S/C22H28N4O3S/c27-22(25-17-15-24(16-18-25)20-9-11-23-12-10-20)19-5-7-21(8-6-19)30(28,29)26-13-3-1-2-4-14-26/h5-12H,1-4,13-18H2