3-(3-chloranyl-4-methoxy-phenyl)-1-[(2-chlorophenyl)methyl]-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 3-(3-chloranyl-4-methoxy-phenyl)-1-[(2-chlorophenyl)methyl]-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 3-(3-chloro-4-methoxy-phenyl)-1-[(2-chlorophenyl)methyl]-1-(3-pyridylmethyl)thiourea CAS Name: 3-(3-chloro-4-methoxyphenyl)-1-[(2-chlorophenyl)methyl]-1-(3-pyridinylmethyl)thiourea IUPAC Name: 3-(3-chloro-4-methoxyphenyl)-1-[(2-chlorophenyl)methyl]-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 1-(2-chlorobenzyl)-3-(3-chloro-4-methoxy-phenyl)-1-(3-pyridylmethyl)thiourea Formula: C21H19Cl2N3OS MolecularWeight: 432.36606

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=S)N(CC2=CN=CC=C2)CC3=CC=CC=C3Cl)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=S)N(CC2=CN=CC=C2)CC3=CC=CC=C3Cl)Cl

InChI

InChI=1S/C21H19Cl2N3OS/c1-27-20-9-8-17(11-19(20)23)25-21(28)26(13-15-5-4-10-24-12-15)14-16-6-2-3-7-18(16)22/h2-12H,13-14H2,1H3,(H,25,28)