(Z)-N-[3-[(4-bromophenyl)methylsulfanyl]-5-propan-2-yl-1,2,4-triazol-4-yl]-2-methyl-3-phenyl-prop-2-en-1-imine

Systemtic Name: (Z)-N-[3-[(4-bromophenyl)methylsulfanyl]-5-propan-2-yl-1,2,4-triazol-4-yl]-2-methyl-3-phenyl-prop-2-en-1-imine Openeye Name: (Z)-N-[3-[(4-bromophenyl)methylsulfanyl]-5-isopropyl-1,2,4-triazol-4-yl]-2-methyl-3-phenyl-prop-2-en-1-imine CAS Name: (Z)-N-[3-[(4-bromophenyl)methylthio]-5-propan-2-yl-1,2,4-triazol-4-yl]-2-methyl-3-phenyl-2-propen-1-imine IUPAC Name: (Z)-N-[3-[(4-bromophenyl)methylsulfanyl]-5-propan-2-yl-1,2,4-triazol-4-yl]-2-methyl-3-phenylprop-2-en-1-imine Traditional Name: (E)-[3-[(4-bromobenzyl)thio]-5-isopropyl-1,2,4-triazol-4-yl]-[(Z)-2-methyl-3-phenyl-prop-2-enylidene]amine Formula: C22H23BrN4S MolecularWeight: 455.41382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(N1N=CC(=CC2=CC=CC=C2)C)SCC3=CC=C(C=C3)Br

Isomeric SMILES

CC(C)C1=NN=C(N1/N=C/C(=C\C2=CC=CC=C2)/C)SCC3=CC=C(C=C3)Br

InChI

InChI=1S/C22H23BrN4S/c1-16(2)21-25-26-22(28-15-19-9-11-20(23)12-10-19)27(21)24-14-17(3)13-18-7-5-4-6-8-18/h4-14,16H,15H2,1-3H3/b17-13-,24-14+