2-[(4-hexyl-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(methylcarbamoyl)ethanamide

Systemtic Name: 2-[(4-hexyl-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(methylcarbamoyl)ethanamide Openeye Name: 2-[(4-hexyl-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(methylcarbamoyl)acetamide CAS Name: 2-[[4-hexyl-5-(3-indolylidene)-1H-1,2,4-triazol-3-yl]thio]-N-(methylcarbamoyl)acetamide IUPAC Name: 2-[(4-hexyl-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(methylcarbamoyl)acetamide Traditional Name: 2-[(4-hexyl-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl)thio]-N-(methylcarbamoyl)acetamide Formula: C20H26N6O2S MolecularWeight: 414.52444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=C2C=NC3=CC=CC=C32)NN=C1SCC(=O)NC(=O)NC

Isomeric SMILES

CCCCCCN1C(=C2C=NC3=CC=CC=C32)NN=C1SCC(=O)NC(=O)NC

InChI

InChI=1S/C20H26N6O2S/c1-3-4-5-8-11-26-18(15-12-22-16-10-7-6-9-14(15)16)24-25-20(26)29-13-17(27)23-19(28)21-2/h6-7,9-10,12,24H,3-5,8,11,13H2,1-2H3,(H2,21,23,27,28)