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

Systemtic Name: 1-cyclopentyl-1-[(2,3-dimethoxyphenyl)methyl]-3-(4-fluorophenyl)thiourea Openeye Name: 1-cyclopentyl-1-[(2,3-dimethoxyphenyl)methyl]-3-(4-fluorophenyl)thiourea CAS Name: 1-cyclopentyl-1-[(2,3-dimethoxyphenyl)methyl]-3-(4-fluorophenyl)thiourea IUPAC Name: 1-cyclopentyl-1-[(2,3-dimethoxyphenyl)methyl]-3-(4-fluorophenyl)thiourea Traditional Name: 1-cyclopentyl-3-(4-fluorophenyl)-1-o-veratryl-thiourea Formula: C21H25FN2O2S MolecularWeight: 388.498803

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)CN(C2CCCC2)C(=S)NC3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC=CC(=C1OC)CN(C2CCCC2)C(=S)NC3=CC=C(C=C3)F

InChI

InChI=1S/C21H25FN2O2S/c1-25-19-9-5-6-15(20(19)26-2)14-24(18-7-3-4-8-18)21(27)23-17-12-10-16(22)11-13-17/h5-6,9-13,18H,3-4,7-8,14H2,1-2H3,(H,23,27)