1-[(3,4-diethoxyphenyl)methyl]-3-[(4-fluorophenyl)methyl]-1-propyl-thiourea

Systemtic Name: 1-[(3,4-diethoxyphenyl)methyl]-3-[(4-fluorophenyl)methyl]-1-propyl-thiourea Openeye Name: 1-[(3,4-diethoxyphenyl)methyl]-3-[(4-fluorophenyl)methyl]-1-propyl-thiourea CAS Name: 1-[(3,4-diethoxyphenyl)methyl]-3-[(4-fluorophenyl)methyl]-1-propylthiourea IUPAC Name: 1-[(3,4-diethoxyphenyl)methyl]-3-[(4-fluorophenyl)methyl]-1-propylthiourea Traditional Name: 1-(3,4-diethoxybenzyl)-3-(4-fluorobenzyl)-1-propyl-thiourea Formula: C22H29FN2O2S MolecularWeight: 404.541263

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC(=C(C=C1)OCC)OCC)C(=S)NCC2=CC=C(C=C2)F

Isomeric SMILES

CCCN(CC1=CC(=C(C=C1)OCC)OCC)C(=S)NCC2=CC=C(C=C2)F

InChI

InChI=1S/C22H29FN2O2S/c1-4-13-25(22(28)24-15-17-7-10-19(23)11-8-17)16-18-9-12-20(26-5-2)21(14-18)27-6-3/h7-12,14H,4-6,13,15-16H2,1-3H3,(H,24,28)