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

Systemtic Name: 3-[4-(2-methoxyethyl)-3-(pyridin-3-ylmethylsulfanyl)-1H-1,2,4-triazol-5-ylidene]indole Openeye Name: 3-[4-(2-methoxyethyl)-3-(3-pyridylmethylsulfanyl)-1H-1,2,4-triazol-5-ylidene]indole CAS Name: 3-[4-(2-methoxyethyl)-3-(3-pyridinylmethylthio)-1H-1,2,4-triazol-5-ylidene]indole IUPAC Name: 3-[4-(2-methoxyethyl)-3-(pyridin-3-ylmethylsulfanyl)-1H-1,2,4-triazol-5-ylidene]indole Traditional Name: 3-[4-(2-methoxyethyl)-3-(3-pyridylmethylthio)-1H-1,2,4-triazol-5-ylidene]indole Formula: C19H19N5OS MolecularWeight: 365.45206

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=C2C=NC3=CC=CC=C32)NN=C1SCC4=CN=CC=C4

Isomeric SMILES

COCCN1C(=C2C=NC3=CC=CC=C32)NN=C1SCC4=CN=CC=C4

InChI

InChI=1S/C19H19N5OS/c1-25-10-9-24-18(16-12-21-17-7-3-2-6-15(16)17)22-23-19(24)26-13-14-5-4-8-20-11-14/h2-8,11-12,22H,9-10,13H2,1H3