5-chloranyl-2-methoxy-N-[(3-methoxyphenyl)methyl]-N-(2-oxidanylidene-2-piperazin-1-yl-ethyl)benzenesulfonamide

Systemtic Name: 5-chloranyl-2-methoxy-N-[(3-methoxyphenyl)methyl]-N-(2-oxidanylidene-2-piperazin-1-yl-ethyl)benzenesulfonamide Openeye Name: 5-chloro-2-methoxy-N-[(3-methoxyphenyl)methyl]-N-(2-oxo-2-piperazin-1-yl-ethyl)benzenesulfonamide CAS Name: 5-chloro-2-methoxy-N-[(3-methoxyphenyl)methyl]-N-[2-oxo-2-(1-piperazinyl)ethyl]benzenesulfonamide IUPAC Name: 5-chloro-2-methoxy-N-[(3-methoxyphenyl)methyl]-N-(2-oxo-2-piperazin-1-ylethyl)benzenesulfonamide Traditional Name: 5-chloro-N-(2-keto-2-piperazino-ethyl)-N-m-anisyl-2-methoxy-benzenesulfonamide Formula: C21H26ClN3O5S MolecularWeight: 467.96624

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)S(=O)(=O)N(CC2=CC(=CC=C2)OC)CC(=O)N3CCNCC3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)S(=O)(=O)N(CC2=CC(=CC=C2)OC)CC(=O)N3CCNCC3

InChI

InChI=1S/C21H26ClN3O5S/c1-29-18-5-3-4-16(12-18)14-25(15-21(26)24-10-8-23-9-11-24)31(27,28)20-13-17(22)6-7-19(20)30-2/h3-7,12-13,23H,8-11,14-15H2,1-2H3