1-cyclopentyl-3-(2,4-dichlorophenyl)-1-[(2,3,4-trimethoxyphenyl)methyl]thiourea

Systemtic Name: 1-cyclopentyl-3-(2,4-dichlorophenyl)-1-[(2,3,4-trimethoxyphenyl)methyl]thiourea Openeye Name: 1-cyclopentyl-3-(2,4-dichlorophenyl)-1-[(2,3,4-trimethoxyphenyl)methyl]thiourea CAS Name: 1-cyclopentyl-3-(2,4-dichlorophenyl)-1-[(2,3,4-trimethoxyphenyl)methyl]thiourea IUPAC Name: 1-cyclopentyl-3-(2,4-dichlorophenyl)-1-[(2,3,4-trimethoxyphenyl)methyl]thiourea Traditional Name: 1-cyclopentyl-3-(2,4-dichlorophenyl)-1-(2,3,4-trimethoxybenzyl)thiourea Formula: C22H26Cl2N2O3S MolecularWeight: 469.42444

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CN(C2CCCC2)C(=S)NC3=C(C=C(C=C3)Cl)Cl)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CN(C2CCCC2)C(=S)NC3=C(C=C(C=C3)Cl)Cl)OC)OC

InChI

InChI=1S/C22H26Cl2N2O3S/c1-27-19-11-8-14(20(28-2)21(19)29-3)13-26(16-6-4-5-7-16)22(30)25-18-10-9-15(23)12-17(18)24/h8-12,16H,4-7,13H2,1-3H3,(H,25,30)