4-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]carbonyl-1-(2-methoxyphenyl)pyrrolidin-2-one

Systemtic Name: 4-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]carbonyl-1-(2-methoxyphenyl)pyrrolidin-2-one Openeye Name: 4-[4-(azepan-1-ylsulfonyl)piperazine-1-carbonyl]-1-(2-methoxyphenyl)pyrrolidin-2-one CAS Name: 4-[[4-(1-azepanylsulfonyl)-1-piperazinyl]-oxomethyl]-1-(2-methoxyphenyl)-2-pyrrolidinone IUPAC Name: 4-[4-(azepan-1-ylsulfonyl)piperazine-1-carbonyl]-1-(2-methoxyphenyl)pyrrolidin-2-one Traditional Name: 4-[4-(azepan-1-ylsulfonyl)piperazine-1-carbonyl]-1-(2-methoxyphenyl)-2-pyrrolidone Formula: C22H32N4O5S MolecularWeight: 464.57828

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CC(CC2=O)C(=O)N3CCN(CC3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

COC1=CC=CC=C1N2CC(CC2=O)C(=O)N3CCN(CC3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C22H32N4O5S/c1-31-20-9-5-4-8-19(20)26-17-18(16-21(26)27)22(28)23-12-14-25(15-13-23)32(29,30)24-10-6-2-3-7-11-24/h4-5,8-9,18H,2-3,6-7,10-17H2,1H3