1-[3-(3,5-dimethoxyphenyl)propanoylamino]-3-[(4-fluorophenyl)methyl]thiourea

Systemtic Name: 1-[3-(3,5-dimethoxyphenyl)propanoylamino]-3-[(4-fluorophenyl)methyl]thiourea Openeye Name: 1-[3-(3,5-dimethoxyphenyl)propanoylamino]-3-[(4-fluorophenyl)methyl]thiourea CAS Name: 1-[[3-(3,5-dimethoxyphenyl)-1-oxopropyl]amino]-3-[(4-fluorophenyl)methyl]thiourea IUPAC Name: 1-[3-(3,5-dimethoxyphenyl)propanoylamino]-3-[(4-fluorophenyl)methyl]thiourea Traditional Name: 1-[3-(3,5-dimethoxyphenyl)propanoylamino]-3-(4-fluorobenzyl)thiourea Formula: C19H22FN3O3S MolecularWeight: 391.459683

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CCC(=O)NNC(=S)NCC2=CC=C(C=C2)F)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CCC(=O)NNC(=S)NCC2=CC=C(C=C2)F)OC

InChI

InChI=1S/C19H22FN3O3S/c1-25-16-9-14(10-17(11-16)26-2)5-8-18(24)22-23-19(27)21-12-13-3-6-15(20)7-4-13/h3-4,6-7,9-11H,5,8,12H2,1-2H3,(H,22,24)(H2,21,23,27)