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

Systemtic Name: 1-(4-butylphenyl)-3-[3-(3,5-dimethoxyphenyl)propanoylamino]thiourea Openeye Name: 1-(4-butylphenyl)-3-[3-(3,5-dimethoxyphenyl)propanoylamino]thiourea CAS Name: 1-(4-butylphenyl)-3-[[3-(3,5-dimethoxyphenyl)-1-oxopropyl]amino]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[3-(3,5-dimethoxyphenyl)propanoylamino]thiourea Traditional Name: 1-(4-butylphenyl)-3-[3-(3,5-dimethoxyphenyl)propanoylamino]thiourea Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)CCC2=CC(=CC(=C2)OC)OC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)CCC2=CC(=CC(=C2)OC)OC

InChI

InChI=1S/C22H29N3O3S/c1-4-5-6-16-7-10-18(11-8-16)23-22(29)25-24-21(26)12-9-17-13-19(27-2)15-20(14-17)28-3/h7-8,10-11,13-15H,4-6,9,12H2,1-3H3,(H,24,26)(H2,23,25,29)