1-(2,3-dimethylphenyl)-3-[2-(3,5-dimethylpyrazol-1-yl)ethanoylamino]thiourea

Systemtic Name: 1-(2,3-dimethylphenyl)-3-[2-(3,5-dimethylpyrazol-1-yl)ethanoylamino]thiourea Openeye Name: 1-(2,3-dimethylphenyl)-3-[[2-(3,5-dimethylpyrazol-1-yl)acetyl]amino]thiourea CAS Name: 1-(2,3-dimethylphenyl)-3-[[2-(3,5-dimethyl-1-pyrazolyl)-1-oxoethyl]amino]thiourea IUPAC Name: 1-(2,3-dimethylphenyl)-3-[[2-(3,5-dimethylpyrazol-1-yl)acetyl]amino]thiourea Traditional Name: 1-(2,3-dimethylphenyl)-3-[[2-(3,5-dimethylpyrazol-1-yl)acetyl]amino]thiourea Formula: C16H21N5OS MolecularWeight: 331.43584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=S)NNC(=O)CN2C(=CC(=N2)C)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=S)NNC(=O)CN2C(=CC(=N2)C)C)C

InChI

InChI=1S/C16H21N5OS/c1-10-6-5-7-14(13(10)4)17-16(23)19-18-15(22)9-21-12(3)8-11(2)20-21/h5-8H,9H2,1-4H3,(H,18,22)(H2,17,19,23)