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

Systemtic Name: 1-[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-3-(2-methoxyphenyl)thiourea Openeye Name: 1-[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-3-(2-methoxyphenyl)thiourea CAS Name: 1-[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]-3-(2-methoxyphenyl)thiourea IUPAC Name: 1-[1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-3-(2-methoxyphenyl)thiourea Traditional Name: 1-[1-(2-chlorobenzyl)-3,5-dimethyl-pyrazol-4-yl]-3-(2-methoxyphenyl)thiourea Formula: C20H21ClN4OS MolecularWeight: 400.92494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2Cl)C)NC(=S)NC3=CC=CC=C3OC

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2Cl)C)NC(=S)NC3=CC=CC=C3OC

InChI

InChI=1S/C20H21ClN4OS/c1-13-19(23-20(27)22-17-10-6-7-11-18(17)26-3)14(2)25(24-13)12-15-8-4-5-9-16(15)21/h4-11H,12H2,1-3H3,(H2,22,23,27)