N-[3-[(4-bromophenyl)methylsulfanyl]-5-propan-2-yl-1,2,4-triazol-4-yl]-1-(3-methylphenyl)methanimine

Systemtic Name: N-[3-[(4-bromophenyl)methylsulfanyl]-5-propan-2-yl-1,2,4-triazol-4-yl]-1-(3-methylphenyl)methanimine Openeye Name: N-[3-[(4-bromophenyl)methylsulfanyl]-5-isopropyl-1,2,4-triazol-4-yl]-1-(m-tolyl)methanimine CAS Name: N-[3-[(4-bromophenyl)methylthio]-5-propan-2-yl-1,2,4-triazol-4-yl]-1-(3-methylphenyl)methanimine IUPAC Name: N-[3-[(4-bromophenyl)methylsulfanyl]-5-propan-2-yl-1,2,4-triazol-4-yl]-1-(3-methylphenyl)methanimine Traditional Name: (E)-[3-[(4-bromobenzyl)thio]-5-isopropyl-1,2,4-triazol-4-yl]-(3-methylbenzylidene)amine Formula: C20H21BrN4S MolecularWeight: 429.37654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C=NN2C(=NN=C2SCC3=CC=C(C=C3)Br)C(C)C

Isomeric SMILES

CC1=CC=CC(=C1)/C=N/N2C(=NN=C2SCC3=CC=C(C=C3)Br)C(C)C

InChI

InChI=1S/C20H21BrN4S/c1-14(2)19-23-24-20(26-13-16-7-9-18(21)10-8-16)25(19)22-12-17-6-4-5-15(3)11-17/h4-12,14H,13H2,1-3H3/b22-12+