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

Systemtic Name: 4-(2,2-diphenylethanoyl)-N-(pyridin-2-ylmethyl)-1-quinolin-8-ylsulfonyl-piperazine-2-carboxamide Openeye Name: 4-(2,2-diphenylacetyl)-N-(2-pyridylmethyl)-1-(8-quinolylsulfonyl)piperazine-2-carboxamide CAS Name: 4-(1-oxo-2,2-diphenylethyl)-N-(2-pyridinylmethyl)-1-(8-quinolinylsulfonyl)-2-piperazinecarboxamide IUPAC Name: 4-(2,2-diphenylacetyl)-N-(pyridin-2-ylmethyl)-1-quinolin-8-ylsulfonylpiperazine-2-carboxamide Traditional Name: 4-(2,2-diphenylacetyl)-N-(2-pyridylmethyl)-1-(8-quinolylsulfonyl)piperazine-2-carboxamide Formula: C34H31N5O4S MolecularWeight: 605.70604

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1C(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NCC4=CC=CC=N4)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=N4)S(=O)(=O)C5=CC=CC6=C5N=CC=C6

InChI

InChI=1S/C34H31N5O4S/c40-33(37-23-28-17-7-8-19-35-28)29-24-38(34(41)31(25-11-3-1-4-12-25)26-13-5-2-6-14-26)21-22-39(29)44(42,43)30-18-9-15-27-16-10-20-36-32(27)30/h1-20,29,31H,21-24H2,(H,37,40)