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

Systemtic Name: 2-[[(5Z)-4-(2,5-dimethoxyphenyl)-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl]sulfanyl]-1-piperidin-1-yl-ethanone Openeye Name: 2-[[(5Z)-4-(2,5-dimethoxyphenyl)-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl]sulfanyl]-1-(1-piperidyl)ethanone CAS Name: 2-[[(5Z)-4-(2,5-dimethoxyphenyl)-5-(3-indolylidene)-1H-1,2,4-triazol-3-yl]thio]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[[(5Z)-4-(2,5-dimethoxyphenyl)-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl]sulfanyl]-1-piperidin-1-ylethanone Traditional Name: 2-[[(5Z)-4-(2,5-dimethoxyphenyl)-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl]thio]-1-piperidino-ethanone Formula: C25H27N5O3S MolecularWeight: 477.57858

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)N2C(=C3C=NC4=CC=CC=C43)NN=C2SCC(=O)N5CCCCC5

Isomeric SMILES

COC1=CC(=C(C=C1)OC)N2/C(=C\3/C=NC4=CC=CC=C43)/NN=C2SCC(=O)N5CCCCC5

InChI

InChI=1S/C25H27N5O3S/c1-32-17-10-11-22(33-2)21(14-17)30-24(19-15-26-20-9-5-4-8-18(19)20)27-28-25(30)34-16-23(31)29-12-6-3-7-13-29/h4-5,8-11,14-15,27H,3,6-7,12-13,16H2,1-2H3/b24-19-