N-[5-[(3S,5R)-3,5-dimethylpiperazin-1-yl]-2-methoxy-phenyl]-2,2-dimethyl-3,4-dihydrochromene-6-sulfonamide

Systemtic Name: N-[5-[(3S,5R)-3,5-dimethylpiperazin-1-yl]-2-methoxy-phenyl]-2,2-dimethyl-3,4-dihydrochromene-6-sulfonamide Openeye Name: N-[5-[(3S,5R)-3,5-dimethylpiperazin-1-yl]-2-methoxy-phenyl]-2,2-dimethyl-chromane-6-sulfonamide CAS Name: N-[5-[(3S,5R)-3,5-dimethyl-1-piperazinyl]-2-methoxyphenyl]-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-sulfonamide IUPAC Name: N-[5-[(3S,5R)-3,5-dimethylpiperazin-1-yl]-2-methoxyphenyl]-2,2-dimethyl-3,4-dihydrochromene-6-sulfonamide Traditional Name: N-[5-[(3S,5R)-3,5-dimethylpiperazino]-2-methoxy-phenyl]-2,2-dimethyl-chroman-6-sulfonamide Formula: C24H33N3O4S MolecularWeight: 459.60152

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(N1)C)C2=CC(=C(C=C2)OC)NS(=O)(=O)C3=CC4=C(C=C3)OC(CC4)(C)C

Isomeric SMILES

C[C@@H]1CN(C[C@@H](N1)C)C2=CC(=C(C=C2)OC)NS(=O)(=O)C3=CC4=C(C=C3)OC(CC4)(C)C

InChI

InChI=1S/C24H33N3O4S/c1-16-14-27(15-17(2)25-16)19-6-8-23(30-5)21(13-19)26-32(28,29)20-7-9-22-18(12-20)10-11-24(3,4)31-22/h6-9,12-13,16-17,25-26H,10-11,14-15H2,1-5H3/t16-,17+