N-(3-indol-1-ylpropyl)-4-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]benzamide

Systemtic Name: N-(3-indol-1-ylpropyl)-4-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]benzamide Openeye Name: N-(3-indol-1-ylpropyl)-4-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]benzamide CAS Name: N-[3-(1-indolyl)propyl]-4-[[2-[(1-methyl-2-imidazolyl)thio]-1-oxoethyl]amino]benzamide IUPAC Name: N-(3-indol-1-ylpropyl)-4-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]benzamide Traditional Name: N-(3-indol-1-ylpropyl)-4-[[2-[(1-methylimidazol-2-yl)thio]acetyl]amino]benzamide Formula: C24H25N5O2S MolecularWeight: 447.5526

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)NCCCN3C=CC4=CC=CC=C43

Isomeric SMILES

CN1C=CN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)NCCCN3C=CC4=CC=CC=C43

InChI

InChI=1S/C24H25N5O2S/c1-28-16-13-26-24(28)32-17-22(30)27-20-9-7-19(8-10-20)23(31)25-12-4-14-29-15-11-18-5-2-3-6-21(18)29/h2-3,5-11,13,15-16H,4,12,14,17H2,1H3,(H,25,31)(H,27,30)