N-(2-ethoxyphenyl)-4-methyl-pyrazole-1-carbothioamide

Systemtic Name: N-(2-ethoxyphenyl)-4-methyl-pyrazole-1-carbothioamide Openeye Name: N-(2-ethoxyphenyl)-4-methyl-pyrazole-1-carbothioamide CAS Name: N-(2-ethoxyphenyl)-4-methyl-1-pyrazolecarbothioamide IUPAC Name: N-(2-ethoxyphenyl)-4-methylpyrazole-1-carbothioamide Traditional Name: 4-methyl-N-o-phenetyl-pyrazole-1-carbothioamide Formula: C13H15N3OS MolecularWeight: 261.3427

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=S)N2C=C(C=N2)C

Isomeric SMILES

CCOC1=CC=CC=C1NC(=S)N2C=C(C=N2)C

InChI

InChI=1S/C13H15N3OS/c1-3-17-12-7-5-4-6-11(12)15-13(18)16-9-10(2)8-14-16/h4-9H,3H2,1-2H3,(H,15,18)