3-(2-chloranyl-4-methoxy-phenyl)-1-cyclopentyl-1-[(2,4-dimethoxyphenyl)methyl]thiourea

Systemtic Name: 3-(2-chloranyl-4-methoxy-phenyl)-1-cyclopentyl-1-[(2,4-dimethoxyphenyl)methyl]thiourea Openeye Name: 3-(2-chloro-4-methoxy-phenyl)-1-cyclopentyl-1-[(2,4-dimethoxyphenyl)methyl]thiourea CAS Name: 3-(2-chloro-4-methoxyphenyl)-1-cyclopentyl-1-[(2,4-dimethoxyphenyl)methyl]thiourea IUPAC Name: 3-(2-chloro-4-methoxyphenyl)-1-cyclopentyl-1-[(2,4-dimethoxyphenyl)methyl]thiourea Traditional Name: 3-(2-chloro-4-methoxy-phenyl)-1-cyclopentyl-1-(2,4-dimethoxybenzyl)thiourea Formula: C22H27ClN2O3S MolecularWeight: 434.97938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27ClN2O3S/c1-26-17-10-11-20(19(23)12-17)24-22(29)25(16-6-4-5-7-16)14-15-8-9-18(27-2)13-21(15)28-3/h8-13,16H,4-7,14H2,1-3H3,(H,24,29)