3-[4-ethyl-3-(pyridin-3-ylmethylsulfanyl)-1H-1,2,4-triazol-5-ylidene]indole

Systemtic Name: 3-[4-ethyl-3-(pyridin-3-ylmethylsulfanyl)-1H-1,2,4-triazol-5-ylidene]indole Openeye Name: 3-[4-ethyl-3-(3-pyridylmethylsulfanyl)-1H-1,2,4-triazol-5-ylidene]indole CAS Name: 3-[4-ethyl-3-(3-pyridinylmethylthio)-1H-1,2,4-triazol-5-ylidene]indole IUPAC Name: 3-[4-ethyl-3-(pyridin-3-ylmethylsulfanyl)-1H-1,2,4-triazol-5-ylidene]indole Traditional Name: 3-[4-ethyl-3-(3-pyridylmethylthio)-1H-1,2,4-triazol-5-ylidene]indole Formula: C18H17N5S MolecularWeight: 335.42608

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C2C=NC3=CC=CC=C32)NN=C1SCC4=CN=CC=C4

Isomeric SMILES

CCN1C(=C2C=NC3=CC=CC=C32)NN=C1SCC4=CN=CC=C4

InChI

InChI=1S/C18H17N5S/c1-2-23-17(15-11-20-16-8-4-3-7-14(15)16)21-22-18(23)24-12-13-6-5-9-19-10-13/h3-11,21H,2,12H2,1H3