2-[2-[(4-hexyl-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]benzamide

Systemtic Name: 2-[2-[(4-hexyl-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]benzamide Openeye Name: 2-[[2-[(4-hexyl-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzamide CAS Name: 2-[[2-[[4-hexyl-5-(3-indolylidene)-1H-1,2,4-triazol-3-yl]thio]-1-oxoethyl]amino]benzamide IUPAC Name: 2-[[2-[(4-hexyl-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzamide Traditional Name: 2-[[2-[(4-hexyl-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl)thio]acetyl]amino]benzamide Formula: C25H28N6O2S MolecularWeight: 476.59382

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=C2C=NC3=CC=CC=C32)NN=C1SCC(=O)NC4=CC=CC=C4C(=O)N

Isomeric SMILES

CCCCCCN1C(=C2C=NC3=CC=CC=C32)NN=C1SCC(=O)NC4=CC=CC=C4C(=O)N

InChI

InChI=1S/C25H28N6O2S/c1-2-3-4-9-14-31-24(19-15-27-20-12-7-5-10-17(19)20)29-30-25(31)34-16-22(32)28-21-13-8-6-11-18(21)23(26)33/h5-8,10-13,15,29H,2-4,9,14,16H2,1H3,(H2,26,33)(H,28,32)