4-[(3-methoxyphenyl)diazenyl]-5-methyl-3-phenyl-pyrazole-1-carbothioamide

Systemtic Name: 4-[(3-methoxyphenyl)diazenyl]-5-methyl-3-phenyl-pyrazole-1-carbothioamide Openeye Name: 4-(3-methoxyphenyl)azo-5-methyl-3-phenyl-pyrazole-1-carbothioamide CAS Name: 4-(3-methoxyphenyl)azo-5-methyl-3-phenyl-1-pyrazolecarbothioamide IUPAC Name: 4-[(3-methoxyphenyl)diazenyl]-5-methyl-3-phenylpyrazole-1-carbothioamide Traditional Name: 4-(3-methoxyphenyl)azo-5-methyl-3-phenyl-pyrazole-1-carbothioamide Formula: C18H17N5OS MolecularWeight: 351.42548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=S)N)C2=CC=CC=C2)N=NC3=CC(=CC=C3)OC

Isomeric SMILES

CC1=C(C(=NN1C(=S)N)C2=CC=CC=C2)N=NC3=CC(=CC=C3)OC

InChI

InChI=1S/C18H17N5OS/c1-12-16(21-20-14-9-6-10-15(11-14)24-2)17(22-23(12)18(19)25)13-7-4-3-5-8-13/h3-11H,1-2H3,(H2,19,25)