4,4-dimethyl-3-propan-2-yl-3H-pyrazole-2-carbothioamide

Systemtic Name: 4,4-dimethyl-3-propan-2-yl-3H-pyrazole-2-carbothioamide Openeye Name: 3-isopropyl-4,4-dimethyl-3H-pyrazole-2-carbothioamide CAS Name: 4,4-dimethyl-3-propan-2-yl-3H-pyrazole-2-carbothioamide IUPAC Name: 4,4-dimethyl-3-propan-2-yl-3H-pyrazole-2-carbothioamide Traditional Name: 5-isopropyl-4,4-dimethyl-2-pyrazoline-1-carbothioamide Formula: C9H17N3S MolecularWeight: 199.31638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(C=NN1C(=S)N)(C)C

Isomeric SMILES

CC(C)C1C(C=NN1C(=S)N)(C)C

InChI

InChI=1S/C9H17N3S/c1-6(2)7-9(3,4)5-11-12(7)8(10)13/h5-7H,1-4H3,(H2,10,13)