1-[(4-chlorophenyl)methyl]-3-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)thiourea

Systemtic Name: 1-[(4-chlorophenyl)methyl]-3-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)thiourea Openeye Name: 1-[(4-chlorophenyl)methyl]-3-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)thiourea CAS Name: 1-[(4-chlorophenyl)methyl]-3-(1-ethyl-3,5-dimethyl-4-pyrazolyl)thiourea IUPAC Name: 1-[(4-chlorophenyl)methyl]-3-(1-ethyl-3,5-dimethylpyrazol-4-yl)thiourea Traditional Name: 1-(4-chlorobenzyl)-3-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)thiourea Formula: C15H19ClN4S MolecularWeight: 322.85616

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)NC(=S)NCC2=CC=C(C=C2)Cl)C

Isomeric SMILES

CCN1C(=C(C(=N1)C)NC(=S)NCC2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C15H19ClN4S/c1-4-20-11(3)14(10(2)19-20)18-15(21)17-9-12-5-7-13(16)8-6-12/h5-8H,4,9H2,1-3H3,(H2,17,18,21)