4-(2,2-diphenylethanoyl)-N-(phenylmethyl)-1-quinolin-8-ylsulfonyl-piperazine-2-carboxamide

Systemtic Name: 4-(2,2-diphenylethanoyl)-N-(phenylmethyl)-1-quinolin-8-ylsulfonyl-piperazine-2-carboxamide Openeye Name: N-benzyl-4-(2,2-diphenylacetyl)-1-(8-quinolylsulfonyl)piperazine-2-carboxamide CAS Name: 4-(1-oxo-2,2-diphenylethyl)-N-(phenylmethyl)-1-(8-quinolinylsulfonyl)-2-piperazinecarboxamide IUPAC Name: N-benzyl-4-(2,2-diphenylacetyl)-1-quinolin-8-ylsulfonylpiperazine-2-carboxamide Traditional Name: N-benzyl-4-(2,2-diphenylacetyl)-1-(8-quinolylsulfonyl)piperazine-2-carboxamide Formula: C35H32N4O4S MolecularWeight: 604.71798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1C(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NCC4=CC=CC=C4)S(=O)(=O)C5=CC=CC6=C5N=CC=C6

Isomeric SMILES

C1CN(C(CN1C(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NCC4=CC=CC=C4)S(=O)(=O)C5=CC=CC6=C5N=CC=C6

InChI

InChI=1S/C35H32N4O4S/c40-34(37-24-26-12-4-1-5-13-26)30-25-38(35(41)32(27-14-6-2-7-15-27)28-16-8-3-9-17-28)22-23-39(30)44(42,43)31-20-10-18-29-19-11-21-36-33(29)31/h1-21,30,32H,22-25H2,(H,37,40)