1-[2-(2,4-dichlorophenyl)ethyl]-3-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)thiourea

Systemtic Name: 1-[2-(2,4-dichlorophenyl)ethyl]-3-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)thiourea Openeye Name: 1-[2-(2,4-dichlorophenyl)ethyl]-3-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)thiourea CAS Name: 1-[2-(2,4-dichlorophenyl)ethyl]-3-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)thiourea IUPAC Name: 1-[2-(2,4-dichlorophenyl)ethyl]-3-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)thiourea Traditional Name: 1-[2-(2,4-dichlorophenyl)ethyl]-3-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)thiourea Formula: C20H20Cl2N4OS MolecularWeight: 435.37

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=S)NCCC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=S)NCCC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H20Cl2N4OS/c1-13-18(19(27)26(25(13)2)16-6-4-3-5-7-16)24-20(28)23-11-10-14-8-9-15(21)12-17(14)22/h3-9,12H,10-11H2,1-2H3,(H2,23,24,28)