4-methyl-N-[4-methyl-1-oxidanylidene-1-[4-(phenylmethyl)-1,4-diazepan-1-yl]pentan-2-yl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[4-methyl-1-oxidanylidene-1-[4-(phenylmethyl)-1,4-diazepan-1-yl]pentan-2-yl]benzenesulfonamide Openeye Name: N-[1-(4-benzyl-1,4-diazepane-1-carbonyl)-3-methyl-butyl]-4-methyl-benzenesulfonamide CAS Name: 4-methyl-N-[4-methyl-1-oxo-1-[4-(phenylmethyl)-1,4-diazepan-1-yl]pentan-2-yl]benzenesulfonamide IUPAC Name: N-[1-(4-benzyl-1,4-diazepan-1-yl)-4-methyl-1-oxopentan-2-yl]-4-methylbenzenesulfonamide Traditional Name: N-[1-(4-benzyl-1,4-diazepane-1-carbonyl)-3-methyl-butyl]-4-methyl-benzenesulfonamide Formula: C25H35N3O3S MolecularWeight: 457.6287

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(C)C)C(=O)N2CCCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(C)C)C(=O)N2CCCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C25H35N3O3S/c1-20(2)18-24(26-32(30,31)23-12-10-21(3)11-13-23)25(29)28-15-7-14-27(16-17-28)19-22-8-5-4-6-9-22/h4-6,8-13,20,24,26H,7,14-19H2,1-3H3