[1-(azepan-1-ylsulfonyl)piperidin-3-yl]-[4-(3-methoxyphenyl)piperazin-1-yl]methanone

Systemtic Name: [1-(azepan-1-ylsulfonyl)piperidin-3-yl]-[4-(3-methoxyphenyl)piperazin-1-yl]methanone Openeye Name: [1-(azepan-1-ylsulfonyl)-3-piperidyl]-[4-(3-methoxyphenyl)piperazin-1-yl]methanone CAS Name: [1-(1-azepanylsulfonyl)-3-piperidinyl]-[4-(3-methoxyphenyl)-1-piperazinyl]methanone IUPAC Name: [1-(azepan-1-ylsulfonyl)piperidin-3-yl]-[4-(3-methoxyphenyl)piperazin-1-yl]methanone Traditional Name: [1-(azepan-1-ylsulfonyl)-3-piperidyl]-[4-(3-methoxyphenyl)piperazino]methanone Formula: C23H36N4O4S MolecularWeight: 464.62134

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)C3CCCN(C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)C3CCCN(C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C23H36N4O4S/c1-31-22-10-6-9-21(18-22)24-14-16-25(17-15-24)23(28)20-8-7-13-27(19-20)32(29,30)26-11-4-2-3-5-12-26/h6,9-10,18,20H,2-5,7-8,11-17,19H2,1H3