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

Systemtic Name: (3Z)-3-[3-[(4-bromophenyl)methylsulfanyl]-4-cyclopropyl-1H-1,2,4-triazol-5-ylidene]indole Openeye Name: (3Z)-3-[3-[(4-bromophenyl)methylsulfanyl]-4-cyclopropyl-1H-1,2,4-triazol-5-ylidene]indole CAS Name: (3Z)-3-[3-[(4-bromophenyl)methylthio]-4-cyclopropyl-1H-1,2,4-triazol-5-ylidene]indole IUPAC Name: (3Z)-3-[3-[(4-bromophenyl)methylsulfanyl]-4-cyclopropyl-1H-1,2,4-triazol-5-ylidene]indole Traditional Name: (3Z)-3-[3-[(4-bromobenzyl)thio]-4-cyclopropyl-1H-1,2,4-triazol-5-ylidene]indole Formula: C20H17BrN4S MolecularWeight: 425.34478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=C3C=NC4=CC=CC=C43)NN=C2SCC5=CC=C(C=C5)Br

Isomeric SMILES

C1CC1N2/C(=C\3/C=NC4=CC=CC=C43)/NN=C2SCC5=CC=C(C=C5)Br

InChI

InChI=1S/C20H17BrN4S/c21-14-7-5-13(6-8-14)12-26-20-24-23-19(25(20)15-9-10-15)17-11-22-18-4-2-1-3-16(17)18/h1-8,11,15,23H,9-10,12H2/b19-17-