N-[(2S)-1-[(3,5-dimethylphenyl)methylamino]-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]benzamide

Systemtic Name: N-[(2S)-1-[(3,5-dimethylphenyl)methylamino]-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]benzamide Openeye Name: N-[(1S)-2-[(3,5-dimethylphenyl)methylamino]-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]benzamide CAS Name: N-[(2S)-1-[(3,5-dimethylphenyl)methylamino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]benzamide IUPAC Name: N-[(2S)-1-[(3,5-dimethylphenyl)methylamino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]benzamide Traditional Name: N-[(1S)-2-[(3,5-dimethylbenzyl)amino]-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]benzamide Formula: C27H27N3O2 MolecularWeight: 425.52218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CNC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=CC(=C1)CNC(=O)[C@H](CC2=CNC3=CC=CC=C32)NC(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C27H27N3O2/c1-18-12-19(2)14-20(13-18)16-29-27(32)25(30-26(31)21-8-4-3-5-9-21)15-22-17-28-24-11-7-6-10-23(22)24/h3-14,17,25,28H,15-16H2,1-2H3,(H,29,32)(H,30,31)/t25-/m0/s1