2-[azanyl(1H-indol-3-yl)methyl]-N-ethanoyl-N-[(2-ethylphenyl)methyl]-3-oxidanylidene-2-(4-piperidin-1-ylpiperidin-1-yl)butanamide

Systemtic Name: 2-[azanyl(1H-indol-3-yl)methyl]-N-ethanoyl-N-[(2-ethylphenyl)methyl]-3-oxidanylidene-2-(4-piperidin-1-ylpiperidin-1-yl)butanamide Openeye Name: N-acetyl-2-[amino(1H-indol-3-yl)methyl]-N-[(2-ethylphenyl)methyl]-3-oxo-2-[4-(1-piperidyl)-1-piperidyl]butanamide CAS Name: N-acetyl-2-[amino(1H-indol-3-yl)methyl]-N-[(2-ethylphenyl)methyl]-3-oxo-2-[4-(1-piperidinyl)-1-piperidinyl]butanamide IUPAC Name: N-acetyl-2-[amino(1H-indol-3-yl)methyl]-N-[(2-ethylphenyl)methyl]-3-oxo-2-(4-piperidin-1-ylpiperidin-1-yl)butanamide Traditional Name: N-acetyl-2-[amino(1H-indol-3-yl)methyl]-N-(2-ethylbenzyl)-3-keto-2-(4-piperidinopiperidino)butyramide Formula: C34H45N5O3 MolecularWeight: 571.7528

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1CN(C(=O)C)C(=O)C(C(C2=CNC3=CC=CC=C32)N)(C(=O)C)N4CCC(CC4)N5CCCCC5

Isomeric SMILES

CCC1=CC=CC=C1CN(C(=O)C)C(=O)C(C(C2=CNC3=CC=CC=C32)N)(C(=O)C)N4CCC(CC4)N5CCCCC5

InChI

InChI=1S/C34H45N5O3/c1-4-26-12-6-7-13-27(26)23-39(25(3)41)33(42)34(24(2)40,32(35)30-22-36-31-15-9-8-14-29(30)31)38-20-16-28(17-21-38)37-18-10-5-11-19-37/h6-9,12-15,22,28,32,36H,4-5,10-11,16-21,23,35H2,1-3H3