1-(2,3-dimethylphenyl)-3-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]thiourea

Systemtic Name: 1-(2,3-dimethylphenyl)-3-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]thiourea Openeye Name: 1-(2,3-dimethylphenyl)-3-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]thiourea CAS Name: 1-(2,3-dimethylphenyl)-3-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]thiourea IUPAC Name: 1-(2,3-dimethylphenyl)-3-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]thiourea Traditional Name: 1-(2,3-dimethylphenyl)-3-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]thiourea Formula: C21H24N4S MolecularWeight: 364.50706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=S)NCC2=C(N(N=C2C)C3=CC=CC=C3)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=S)NCC2=C(N(N=C2C)C3=CC=CC=C3)C)C

InChI

InChI=1S/C21H24N4S/c1-14-9-8-12-20(15(14)2)23-21(26)22-13-19-16(3)24-25(17(19)4)18-10-6-5-7-11-18/h5-12H,13H2,1-4H3,(H2,22,23,26)