1-(3-chlorophenyl)-3-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]carbonylamino]thiourea

Systemtic Name: 1-(3-chlorophenyl)-3-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]carbonylamino]thiourea Openeye Name: 1-[(1-benzyl-3,5-dimethyl-pyrazole-4-carbonyl)amino]-3-(3-chlorophenyl)thiourea CAS Name: 1-(3-chlorophenyl)-3-[[[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]-oxomethyl]amino]thiourea IUPAC Name: 1-[(1-benzyl-3,5-dimethylpyrazole-4-carbonyl)amino]-3-(3-chlorophenyl)thiourea Traditional Name: 1-[(1-benzyl-3,5-dimethyl-pyrazole-4-carbonyl)amino]-3-(3-chlorophenyl)thiourea Formula: C20H20ClN5OS MolecularWeight: 413.9237

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)C(=O)NNC(=S)NC3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)C(=O)NNC(=S)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H20ClN5OS/c1-13-18(14(2)26(25-13)12-15-7-4-3-5-8-15)19(27)23-24-20(28)22-17-10-6-9-16(21)11-17/h3-11H,12H2,1-2H3,(H,23,27)(H2,22,24,28)