1-(3,4-dimethylphenyl)-3-[2-(3,5-dimethylpyrazol-1-yl)ethanoylamino]thiourea

Systemtic Name: 1-(3,4-dimethylphenyl)-3-[2-(3,5-dimethylpyrazol-1-yl)ethanoylamino]thiourea Openeye Name: 1-(3,4-dimethylphenyl)-3-[[2-(3,5-dimethylpyrazol-1-yl)acetyl]amino]thiourea CAS Name: 1-(3,4-dimethylphenyl)-3-[[2-(3,5-dimethyl-1-pyrazolyl)-1-oxoethyl]amino]thiourea IUPAC Name: 1-(3,4-dimethylphenyl)-3-[[2-(3,5-dimethylpyrazol-1-yl)acetyl]amino]thiourea Traditional Name: 1-(3,4-dimethylphenyl)-3-[[2-(3,5-dimethylpyrazol-1-yl)acetyl]amino]thiourea Formula: C16H21N5OS MolecularWeight: 331.43584

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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