3-(3-bromophenyl)-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazol-4-amine

Systemtic Name: 3-(3-bromophenyl)-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazol-4-amine Openeye Name: 3-(3-bromophenyl)-5-[(E)-cinnamyl]sulfanyl-1,2,4-triazol-4-amine CAS Name: 3-(3-bromophenyl)-5-[[(E)-3-phenylprop-2-enyl]thio]-1,2,4-triazol-4-amine IUPAC Name: 3-(3-bromophenyl)-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazol-4-amine Traditional Name: [3-(3-bromophenyl)-5-[[(E)-cinnamyl]thio]-1,2,4-triazol-4-yl]amine Formula: C17H15BrN4S MolecularWeight: 387.2968

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CCSC2=NN=C(N2N)C3=CC(=CC=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)/C=C/CSC2=NN=C(N2N)C3=CC(=CC=C3)Br

InChI

InChI=1S/C17H15BrN4S/c18-15-10-4-9-14(12-15)16-20-21-17(22(16)19)23-11-5-8-13-6-2-1-3-7-13/h1-10,12H,11,19H2/b8-5+