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

Systemtic Name: 3-[3-[(4-bromophenyl)methylsulfanyl]-4-ethyl-1H-1,2,4-triazol-5-ylidene]indole Openeye Name: 3-[3-[(4-bromophenyl)methylsulfanyl]-4-ethyl-1H-1,2,4-triazol-5-ylidene]indole CAS Name: 3-[3-[(4-bromophenyl)methylthio]-4-ethyl-1H-1,2,4-triazol-5-ylidene]indole IUPAC Name: 3-[3-[(4-bromophenyl)methylsulfanyl]-4-ethyl-1H-1,2,4-triazol-5-ylidene]indole Traditional Name: 3-[3-[(4-bromobenzyl)thio]-4-ethyl-1H-1,2,4-triazol-5-ylidene]indole Formula: C19H17BrN4S MolecularWeight: 413.33408

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C2C=NC3=CC=CC=C32)NN=C1SCC4=CC=C(C=C4)Br

Isomeric SMILES

CCN1C(=C2C=NC3=CC=CC=C32)NN=C1SCC4=CC=C(C=C4)Br

InChI

InChI=1S/C19H17BrN4S/c1-2-24-18(16-11-21-17-6-4-3-5-15(16)17)22-23-19(24)25-12-13-7-9-14(20)10-8-13/h3-11,22H,2,12H2,1H3