[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-[4-(pyridin-3-ylmethoxy)phenyl]methanone

Systemtic Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-[4-(pyridin-3-ylmethoxy)phenyl]methanone Openeye Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-[4-(3-pyridylmethoxy)phenyl]methanone CAS Name: [4-(1-azepanylsulfonyl)-1-piperazinyl]-[4-(3-pyridinylmethoxy)phenyl]methanone IUPAC Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-[4-(pyridin-3-ylmethoxy)phenyl]methanone Traditional Name: [4-(azepan-1-ylsulfonyl)piperazino]-[4-(3-pyridylmethoxy)phenyl]methanone Formula: C23H30N4O4S MolecularWeight: 458.5737

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)OCC4=CN=CC=C4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)OCC4=CN=CC=C4

InChI

InChI=1S/C23H30N4O4S/c28-23(21-7-9-22(10-8-21)31-19-20-6-5-11-24-18-20)25-14-16-27(17-15-25)32(29,30)26-12-3-1-2-4-13-26/h5-11,18H,1-4,12-17,19H2