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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25FN2O2S/c1-25-19-12-7-15(20(13-19)26-2)14-24(18-5-3-4-6-18)21(27)23-17-10-8-16(22)9-11-17/h7-13,18H,3-6,14H2,1-2H3,(H,23,27)