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

Systemtic Name: 3-(4-chlorophenyl)-1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-1-methyl-thiourea Openeye Name: 3-(4-chlorophenyl)-1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-1-methyl-thiourea CAS Name: 3-(4-chlorophenyl)-1-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-1-methylthiourea IUPAC Name: 3-(4-chlorophenyl)-1-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-1-methylthiourea Traditional Name: 3-(4-chlorophenyl)-1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-1-methyl-thiourea Formula: C20H21ClN4S MolecularWeight: 384.92554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CN(C)C(=S)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CN(C)C(=S)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H21ClN4S/c1-14-19(15(2)25(23-14)18-7-5-4-6-8-18)13-24(3)20(26)22-17-11-9-16(21)10-12-17/h4-12H,13H2,1-3H3,(H,22,26)