1-(4-chlorophenyl)-3-[3-(3,5-dimethylpyrazol-1-yl)propanoylamino]thiourea

Systemtic Name: 1-(4-chlorophenyl)-3-[3-(3,5-dimethylpyrazol-1-yl)propanoylamino]thiourea Openeye Name: 1-(4-chlorophenyl)-3-[3-(3,5-dimethylpyrazol-1-yl)propanoylamino]thiourea CAS Name: 1-(4-chlorophenyl)-3-[[3-(3,5-dimethyl-1-pyrazolyl)-1-oxopropyl]amino]thiourea IUPAC Name: 1-(4-chlorophenyl)-3-[3-(3,5-dimethylpyrazol-1-yl)propanoylamino]thiourea Traditional Name: 1-(4-chlorophenyl)-3-[3-(3,5-dimethylpyrazol-1-yl)propanoylamino]thiourea Formula: C15H18ClN5OS MolecularWeight: 351.85432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCC(=O)NNC(=S)NC2=CC=C(C=C2)Cl)C

Isomeric SMILES

CC1=CC(=NN1CCC(=O)NNC(=S)NC2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C15H18ClN5OS/c1-10-9-11(2)21(20-10)8-7-14(22)18-19-15(23)17-13-5-3-12(16)4-6-13/h3-6,9H,7-8H2,1-2H3,(H,18,22)(H2,17,19,23)