2-[[5-(3-bromophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methylideneamino]ethanamide

Systemtic Name: 2-[[5-(3-bromophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methylideneamino]ethanamide Openeye Name: 2-[[5-(3-bromophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyleneamino]acetamide CAS Name: 2-[[5-(3-bromophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-N-[(E)-(1-ethyl-3,5-dimethyl-4-pyrazolyl)methylideneamino]acetamide IUPAC Name: 2-[[5-(3-bromophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-(1-ethyl-3,5-dimethylpyrazol-4-yl)methylideneamino]acetamide Traditional Name: 2-[[5-(3-bromophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-N-[(E)-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyleneamino]acetamide Formula: C19H22BrN7OS MolecularWeight: 476.39328

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)C=NNC(=O)CSC2=NN=C(N2C)C3=CC(=CC=C3)Br)C

Isomeric SMILES

CCN1C(=C(C(=N1)C)/C=N/NC(=O)CSC2=NN=C(N2C)C3=CC(=CC=C3)Br)C

InChI

InChI=1S/C19H22BrN7OS/c1-5-27-13(3)16(12(2)25-27)10-21-22-17(28)11-29-19-24-23-18(26(19)4)14-7-6-8-15(20)9-14/h6-10H,5,11H2,1-4H3,(H,22,28)/b21-10+