3-[3-[(3-fluorophenyl)methylsulfanyl]-4-hexyl-1H-1,2,4-triazol-5-ylidene]indole

Systemtic Name: 3-[3-[(3-fluorophenyl)methylsulfanyl]-4-hexyl-1H-1,2,4-triazol-5-ylidene]indole Openeye Name: 3-[3-[(3-fluorophenyl)methylsulfanyl]-4-hexyl-1H-1,2,4-triazol-5-ylidene]indole CAS Name: 3-[3-[(3-fluorophenyl)methylthio]-4-hexyl-1H-1,2,4-triazol-5-ylidene]indole IUPAC Name: 3-[3-[(3-fluorophenyl)methylsulfanyl]-4-hexyl-1H-1,2,4-triazol-5-ylidene]indole Traditional Name: 3-[3-[(3-fluorobenzyl)thio]-4-hexyl-1H-1,2,4-triazol-5-ylidene]indole Formula: C23H25FN4S MolecularWeight: 408.534803

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=C2C=NC3=CC=CC=C32)NN=C1SCC4=CC(=CC=C4)F

Isomeric SMILES

CCCCCCN1C(=C2C=NC3=CC=CC=C32)NN=C1SCC4=CC(=CC=C4)F

InChI

InChI=1S/C23H25FN4S/c1-2-3-4-7-13-28-22(20-15-25-21-12-6-5-11-19(20)21)26-27-23(28)29-16-17-9-8-10-18(24)14-17/h5-6,8-12,14-15,26H,2-4,7,13,16H2,1H3