N-[3-methyl-1-oxidanylidene-1-(4-phenylpiperazin-1-yl)butan-2-yl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide

Systemtic Name: N-[3-methyl-1-oxidanylidene-1-(4-phenylpiperazin-1-yl)butan-2-yl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-[2-methyl-1-(4-phenylpiperazine-1-carbonyl)propyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-[3-methyl-1-oxo-1-(4-phenyl-1-piperazinyl)butan-2-yl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-[3-methyl-1-oxo-1-(4-phenylpiperazin-1-yl)butan-2-yl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-[2-methyl-1-(4-phenylpiperazine-1-carbonyl)propyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C24H31N3O5S MolecularWeight: 473.58504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCN(CC1)C2=CC=CC=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC(C)C(C(=O)N1CCN(CC1)C2=CC=CC=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C24H31N3O5S/c1-18(2)23(24(28)27-13-11-26(12-14-27)19-7-4-3-5-8-19)25-33(29,30)20-9-10-21-22(17-20)32-16-6-15-31-21/h3-5,7-10,17-18,23,25H,6,11-16H2,1-2H3