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

Systemtic Name: 3-(4-chloranyl-3-methyl-phenyl)-1-cyclopentyl-1-[(2,3,4-trimethoxyphenyl)methyl]thiourea Openeye Name: 3-(4-chloro-3-methyl-phenyl)-1-cyclopentyl-1-[(2,3,4-trimethoxyphenyl)methyl]thiourea CAS Name: 3-(4-chloro-3-methylphenyl)-1-cyclopentyl-1-[(2,3,4-trimethoxyphenyl)methyl]thiourea IUPAC Name: 3-(4-chloro-3-methylphenyl)-1-cyclopentyl-1-[(2,3,4-trimethoxyphenyl)methyl]thiourea Traditional Name: 3-(4-chloro-3-methyl-phenyl)-1-cyclopentyl-1-(2,3,4-trimethoxybenzyl)thiourea Formula: C23H29ClN2O3S MolecularWeight: 449.00596

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29ClN2O3S/c1-15-13-17(10-11-19(15)24)25-23(30)26(18-7-5-6-8-18)14-16-9-12-20(27-2)22(29-4)21(16)28-3/h9-13,18H,5-8,14H2,1-4H3,(H,25,30)