N-[3-(1H-indol-3-yl)-1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl]quinoline-3-carboxamide

Systemtic Name: N-[3-(1H-indol-3-yl)-1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl]quinoline-3-carboxamide Openeye Name: N-[2-(benzylamino)-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]quinoline-3-carboxamide CAS Name: N-[3-(1H-indol-3-yl)-1-oxo-1-[(phenylmethyl)amino]propan-2-yl]-3-quinolinecarboxamide IUPAC Name: N-[1-(benzylamino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]quinoline-3-carboxamide Traditional Name: N-[2-(benzylamino)-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]quinoline-3-carboxamide Formula: C28H24N4O2 MolecularWeight: 448.51576

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)C4=CC5=CC=CC=C5N=C4

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)C4=CC5=CC=CC=C5N=C4

InChI

InChI=1S/C28H24N4O2/c33-27(22-14-20-10-4-6-12-24(20)29-18-22)32-26(28(34)31-16-19-8-2-1-3-9-19)15-21-17-30-25-13-7-5-11-23(21)25/h1-14,17-18,26,30H,15-16H2,(H,31,34)(H,32,33)