N-(4-ethylphenyl)-2-methoxy-5-(4-methylsulfonylpiperazin-1-yl)carbonyl-benzenesulfonamide

Systemtic Name: N-(4-ethylphenyl)-2-methoxy-5-(4-methylsulfonylpiperazin-1-yl)carbonyl-benzenesulfonamide Openeye Name: N-(4-ethylphenyl)-2-methoxy-5-(4-methylsulfonylpiperazine-1-carbonyl)benzenesulfonamide CAS Name: N-(4-ethylphenyl)-2-methoxy-5-[(4-methylsulfonyl-1-piperazinyl)-oxomethyl]benzenesulfonamide IUPAC Name: N-(4-ethylphenyl)-2-methoxy-5-(4-methylsulfonylpiperazine-1-carbonyl)benzenesulfonamide Traditional Name: N-(4-ethylphenyl)-5-(4-mesylpiperazine-1-carbonyl)-2-methoxy-benzenesulfonamide Formula: C21H27N3O6S2 MolecularWeight: 481.58558

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCN(CC3)S(=O)(=O)C)OC

Isomeric SMILES

CCC1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCN(CC3)S(=O)(=O)C)OC

InChI

InChI=1S/C21H27N3O6S2/c1-4-16-5-8-18(9-6-16)22-32(28,29)20-15-17(7-10-19(20)30-2)21(25)23-11-13-24(14-12-23)31(3,26)27/h5-10,15,22H,4,11-14H2,1-3H3