1-(3-chloranyl-4-methyl-phenyl)-3-(2-phenyl-3,4-dihydropyrazol-5-yl)thiourea

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-3-(2-phenyl-3,4-dihydropyrazol-5-yl)thiourea Openeye Name: 1-(3-chloro-4-methyl-phenyl)-3-(2-phenyl-3,4-dihydropyrazol-5-yl)thiourea CAS Name: 1-(3-chloro-4-methylphenyl)-3-(2-phenyl-3,4-dihydropyrazol-5-yl)thiourea IUPAC Name: 1-(3-chloro-4-methylphenyl)-3-(2-phenyl-3,4-dihydropyrazol-5-yl)thiourea Traditional Name: 1-(3-chloro-4-methyl-phenyl)-3-(1-phenyl-2-pyrazolin-3-yl)thiourea Formula: C17H17ClN4S MolecularWeight: 344.86168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NC2=NN(CC2)C3=CC=CC=C3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NC2=NN(CC2)C3=CC=CC=C3)Cl

InChI

InChI=1S/C17H17ClN4S/c1-12-7-8-13(11-15(12)18)19-17(23)20-16-9-10-22(21-16)14-5-3-2-4-6-14/h2-8,11H,9-10H2,1H3,(H2,19,20,21,23)