4-azanyl-N-[3-(1H-indol-3-yl)-1-oxidanylidene-1-[phenyl-(phenylmethyl)amino]propan-2-yl]butanamide

Systemtic Name: 4-azanyl-N-[3-(1H-indol-3-yl)-1-oxidanylidene-1-[phenyl-(phenylmethyl)amino]propan-2-yl]butanamide Openeye Name: 4-amino-N-[2-(N-benzylanilino)-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]butanamide CAS Name: 4-amino-N-[3-(1H-indol-3-yl)-1-oxo-1-(N-(phenylmethyl)anilino)propan-2-yl]butanamide IUPAC Name: 4-amino-N-[1-(N-benzylanilino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]butanamide Traditional Name: 4-amino-N-[2-(N-benzylanilino)-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]butyramide Formula: C28H30N4O2 MolecularWeight: 454.5634

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(C2=CC=CC=C2)C(=O)C(CC3=CNC4=CC=CC=C43)NC(=O)CCCN

Isomeric SMILES

C1=CC=C(C=C1)CN(C2=CC=CC=C2)C(=O)C(CC3=CNC4=CC=CC=C43)NC(=O)CCCN

InChI

InChI=1S/C28H30N4O2/c29-17-9-16-27(33)31-26(18-22-19-30-25-15-8-7-14-24(22)25)28(34)32(23-12-5-2-6-13-23)20-21-10-3-1-4-11-21/h1-8,10-15,19,26,30H,9,16-18,20,29H2,(H,31,33)