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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H36N4O4S/c1-31-22-10-8-21(9-11-22)24-15-17-25(18-16-24)23(28)20-7-6-14-27(19-20)32(29,30)26-12-4-2-3-5-13-26/h8-11,20H,2-7,12-19H2,1H3