1-[3-chloranyl-4-(1-methylsulfonylpiperidin-4-yl)oxy-phenyl]carbonyl-1,4-diazepan-5-one

Systemtic Name: 1-[3-chloranyl-4-(1-methylsulfonylpiperidin-4-yl)oxy-phenyl]carbonyl-1,4-diazepan-5-one Openeye Name: 1-[3-chloro-4-[(1-methylsulfonyl-4-piperidyl)oxy]benzoyl]-1,4-diazepan-5-one CAS Name: 1-[[3-chloro-4-[(1-methylsulfonyl-4-piperidinyl)oxy]phenyl]-oxomethyl]-1,4-diazepan-5-one IUPAC Name: 1-[3-chloro-4-(1-methylsulfonylpiperidin-4-yl)oxybenzoyl]-1,4-diazepan-5-one Traditional Name: 1-[3-chloro-4-[(1-mesyl-4-piperidyl)oxy]benzoyl]-1,4-diazepan-5-one Formula: C18H24ClN3O5S MolecularWeight: 429.91826

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)OC2=C(C=C(C=C2)C(=O)N3CCC(=O)NCC3)Cl

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)OC2=C(C=C(C=C2)C(=O)N3CCC(=O)NCC3)Cl

InChI

InChI=1S/C18H24ClN3O5S/c1-28(25,26)22-9-4-14(5-10-22)27-16-3-2-13(12-15(16)19)18(24)21-8-6-17(23)20-7-11-21/h2-3,12,14H,4-11H2,1H3,(H,20,23)