N,N-diethyl-4-[3-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-3-oxidanylidene-propyl]benzenesulfonamide

Systemtic Name: N,N-diethyl-4-[3-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-3-oxidanylidene-propyl]benzenesulfonamide Openeye Name: N,N-diethyl-4-[3-oxo-3-[4-(p-tolylmethyl)-1,4-diazepan-1-yl]propyl]benzenesulfonamide CAS Name: N,N-diethyl-4-[3-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-3-oxopropyl]benzenesulfonamide IUPAC Name: N,N-diethyl-4-[3-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-3-oxopropyl]benzenesulfonamide Traditional Name: N,N-diethyl-4-[3-keto-3-[4-(4-methylbenzyl)-1,4-diazepan-1-yl]propyl]benzenesulfonamide Formula: C26H37N3O3S MolecularWeight: 471.65528

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)CCC(=O)N2CCCN(CC2)CC3=CC=C(C=C3)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)CCC(=O)N2CCCN(CC2)CC3=CC=C(C=C3)C

InChI

InChI=1S/C26H37N3O3S/c1-4-29(5-2)33(31,32)25-14-11-23(12-15-25)13-16-26(30)28-18-6-17-27(19-20-28)21-24-9-7-22(3)8-10-24/h7-12,14-15H,4-6,13,16-21H2,1-3H3