1-[4-chloranyl-1-(phenylmethyl)pyrazol-3-yl]-3-(2,4-dimethylphenyl)thiourea

Systemtic Name: 1-[4-chloranyl-1-(phenylmethyl)pyrazol-3-yl]-3-(2,4-dimethylphenyl)thiourea Openeye Name: 1-(1-benzyl-4-chloro-pyrazol-3-yl)-3-(2,4-dimethylphenyl)thiourea CAS Name: 1-[4-chloro-1-(phenylmethyl)-3-pyrazolyl]-3-(2,4-dimethylphenyl)thiourea IUPAC Name: 1-(1-benzyl-4-chloropyrazol-3-yl)-3-(2,4-dimethylphenyl)thiourea Traditional Name: 1-(1-benzyl-4-chloro-pyrazol-3-yl)-3-(2,4-dimethylphenyl)thiourea Formula: C19H19ClN4S MolecularWeight: 370.89896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)NC2=NN(C=C2Cl)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)NC2=NN(C=C2Cl)CC3=CC=CC=C3)C

InChI

InChI=1S/C19H19ClN4S/c1-13-8-9-17(14(2)10-13)21-19(25)22-18-16(20)12-24(23-18)11-15-6-4-3-5-7-15/h3-10,12H,11H2,1-2H3,(H2,21,22,23,25)