2-ethoxy-6-methoxy-N-[5-(4-propyloctan-4-yl)-1H-pyrazol-3-yl]benzenecarbothioamide

Systemtic Name: 2-ethoxy-6-methoxy-N-[5-(4-propyloctan-4-yl)-1H-pyrazol-3-yl]benzenecarbothioamide Openeye Name: N-[5-(1,1-dipropylpentyl)-1H-pyrazol-3-yl]-2-ethoxy-6-methoxy-benzenecarbothioamide CAS Name: 2-ethoxy-6-methoxy-N-[5-(4-propyloctan-4-yl)-1H-pyrazol-3-yl]benzenecarbothioamide IUPAC Name: 2-ethoxy-6-methoxy-N-[5-(4-propyloctan-4-yl)-1H-pyrazol-3-yl]benzenecarbothioamide Traditional Name: N-[5-(1,1-dipropylpentyl)-1H-pyrazol-3-yl]-2-ethoxy-6-methoxy-thiobenzamide Formula: C24H37N3O2S MolecularWeight: 431.63448

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCC)(CCC)C1=CC(=NN1)NC(=S)C2=C(C=CC=C2OCC)OC

Isomeric SMILES

CCCCC(CCC)(CCC)C1=CC(=NN1)NC(=S)C2=C(C=CC=C2OCC)OC

InChI

InChI=1S/C24H37N3O2S/c1-6-10-16-24(14-7-2,15-8-3)20-17-21(27-26-20)25-23(30)22-18(28-5)12-11-13-19(22)29-9-4/h11-13,17H,6-10,14-16H2,1-5H3,(H2,25,26,27,30)