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

Systemtic Name: 3-(4-chloranyl-3-methyl-phenyl)-1-cyclopentyl-1-[(2,3-dimethoxyphenyl)methyl]thiourea Openeye Name: 3-(4-chloro-3-methyl-phenyl)-1-cyclopentyl-1-[(2,3-dimethoxyphenyl)methyl]thiourea CAS Name: 3-(4-chloro-3-methylphenyl)-1-cyclopentyl-1-[(2,3-dimethoxyphenyl)methyl]thiourea IUPAC Name: 3-(4-chloro-3-methylphenyl)-1-cyclopentyl-1-[(2,3-dimethoxyphenyl)methyl]thiourea Traditional Name: 3-(4-chloro-3-methyl-phenyl)-1-cyclopentyl-1-o-veratryl-thiourea Formula: C22H27ClN2O2S MolecularWeight: 418.97998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=S)N(CC2=C(C(=CC=C2)OC)OC)C3CCCC3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=S)N(CC2=C(C(=CC=C2)OC)OC)C3CCCC3)Cl

InChI

InChI=1S/C22H27ClN2O2S/c1-15-13-17(11-12-19(15)23)24-22(28)25(18-8-4-5-9-18)14-16-7-6-10-20(26-2)21(16)27-3/h6-7,10-13,18H,4-5,8-9,14H2,1-3H3,(H,24,28)