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

Systemtic Name: 1-(2,5-dimethoxyphenyl)-2-[(4-hexyl-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 1-(2,5-dimethoxyphenyl)-2-[(4-hexyl-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone CAS Name: 1-(2,5-dimethoxyphenyl)-2-[[4-hexyl-5-(3-indolylidene)-1H-1,2,4-triazol-3-yl]thio]ethanone IUPAC Name: 1-(2,5-dimethoxyphenyl)-2-[(4-hexyl-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 1-(2,5-dimethoxyphenyl)-2-[(4-hexyl-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl)thio]ethanone Formula: C26H30N4O3S MolecularWeight: 478.6064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=C2C=NC3=CC=CC=C32)NN=C1SCC(=O)C4=C(C=CC(=C4)OC)OC

Isomeric SMILES

CCCCCCN1C(=C2C=NC3=CC=CC=C32)NN=C1SCC(=O)C4=C(C=CC(=C4)OC)OC

InChI

InChI=1S/C26H30N4O3S/c1-4-5-6-9-14-30-25(21-16-27-22-11-8-7-10-19(21)22)28-29-26(30)34-17-23(31)20-15-18(32-2)12-13-24(20)33-3/h7-8,10-13,15-16,28H,4-6,9,14,17H2,1-3H3