1-[(2,4-dichlorophenyl)methyl]-3-(2-methoxy-4-methyl-phenyl)-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 1-[(2,4-dichlorophenyl)methyl]-3-(2-methoxy-4-methyl-phenyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 1-[(2,4-dichlorophenyl)methyl]-3-(2-methoxy-4-methyl-phenyl)-1-(3-pyridylmethyl)thiourea CAS Name: 1-[(2,4-dichlorophenyl)methyl]-3-(2-methoxy-4-methylphenyl)-1-(3-pyridinylmethyl)thiourea IUPAC Name: 1-[(2,4-dichlorophenyl)methyl]-3-(2-methoxy-4-methylphenyl)-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 1-(2,4-dichlorobenzyl)-3-(2-methoxy-4-methyl-phenyl)-1-(3-pyridylmethyl)thiourea Formula: C22H21Cl2N3OS MolecularWeight: 446.39264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)N(CC2=CN=CC=C2)CC3=C(C=C(C=C3)Cl)Cl)OC

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)N(CC2=CN=CC=C2)CC3=C(C=C(C=C3)Cl)Cl)OC

InChI

InChI=1S/C22H21Cl2N3OS/c1-15-5-8-20(21(10-15)28-2)26-22(29)27(13-16-4-3-9-25-12-16)14-17-6-7-18(23)11-19(17)24/h3-12H,13-14H2,1-2H3,(H,26,29)