N-(1,3-benzodioxol-5-ylmethyl)-N-[(3-butyl-2,5-diphenyl-imidazol-4-yl)methyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(3-butyl-2,5-diphenyl-imidazol-4-yl)methyl]-4-methyl-benzenesulfonamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(3-butyl-2,5-diphenyl-imidazol-4-yl)methyl]-4-methyl-benzenesulfonamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(3-butyl-2,5-diphenyl-4-imidazolyl)methyl]-4-methylbenzenesulfonamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(3-butyl-2,5-diphenylimidazol-4-yl)methyl]-4-methylbenzenesulfonamide Traditional Name: N-[(3-butyl-2,5-diphenyl-imidazol-4-yl)methyl]-4-methyl-N-piperonyl-benzenesulfonamide Formula: C35H35N3O4S MolecularWeight: 593.7351

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(N=C1C2=CC=CC=C2)C3=CC=CC=C3)CN(CC4=CC5=C(C=C4)OCO5)S(=O)(=O)C6=CC=C(C=C6)C

Isomeric SMILES

CCCCN1C(=C(N=C1C2=CC=CC=C2)C3=CC=CC=C3)CN(CC4=CC5=C(C=C4)OCO5)S(=O)(=O)C6=CC=C(C=C6)C

InChI

InChI=1S/C35H35N3O4S/c1-3-4-21-38-31(34(28-11-7-5-8-12-28)36-35(38)29-13-9-6-10-14-29)24-37(43(39,40)30-18-15-26(2)16-19-30)23-27-17-20-32-33(22-27)42-25-41-32/h5-20,22H,3-4,21,23-25H2,1-2H3