4-[bis(2-cyanoethyl)sulfamoyl]-N-(1,2-dihydroacenaphthylen-5-yl)benzamide

Systemtic Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-(1,2-dihydroacenaphthylen-5-yl)benzamide Openeye Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-(1,2-dihydroacenaphthylen-5-yl)benzamide CAS Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-(1,2-dihydroacenaphthylen-5-yl)benzamide IUPAC Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-(1,2-dihydroacenaphthylen-5-yl)benzamide Traditional Name: N-acenaphthen-5-yl-4-[bis(2-cyanoethyl)sulfamoyl]benzamide Formula: C25H22N4O3S MolecularWeight: 458.53218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC3=C(C=CC1=C23)NC(=O)C4=CC=C(C=C4)S(=O)(=O)N(CCC#N)CCC#N

Isomeric SMILES

C1CC2=CC=CC3=C(C=CC1=C23)NC(=O)C4=CC=C(C=C4)S(=O)(=O)N(CCC#N)CCC#N

InChI

InChI=1S/C25H22N4O3S/c26-14-2-16-29(17-3-15-27)33(31,32)21-11-8-20(9-12-21)25(30)28-23-13-10-19-7-6-18-4-1-5-22(23)24(18)19/h1,4-5,8-13H,2-3,6-7,16-17H2,(H,28,30)