3-(2,4-dichlorophenyl)-1-(3-imidazol-1-ylpropyl)-1-[(2-methoxyphenyl)methyl]thiourea

Systemtic Name: 3-(2,4-dichlorophenyl)-1-(3-imidazol-1-ylpropyl)-1-[(2-methoxyphenyl)methyl]thiourea Openeye Name: 3-(2,4-dichlorophenyl)-1-(3-imidazol-1-ylpropyl)-1-[(2-methoxyphenyl)methyl]thiourea CAS Name: 3-(2,4-dichlorophenyl)-1-[3-(1-imidazolyl)propyl]-1-[(2-methoxyphenyl)methyl]thiourea IUPAC Name: 3-(2,4-dichlorophenyl)-1-(3-imidazol-1-ylpropyl)-1-[(2-methoxyphenyl)methyl]thiourea Traditional Name: 3-(2,4-dichlorophenyl)-1-(3-imidazol-1-ylpropyl)-1-o-anisyl-thiourea Formula: C21H22Cl2N4OS MolecularWeight: 449.39658

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CN(CCCN2C=CN=C2)C(=S)NC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

COC1=CC=CC=C1CN(CCCN2C=CN=C2)C(=S)NC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H22Cl2N4OS/c1-28-20-6-3-2-5-16(20)14-27(11-4-10-26-12-9-24-15-26)21(29)25-19-8-7-17(22)13-18(19)23/h2-3,5-9,12-13,15H,4,10-11,14H2,1H3,(H,25,29)