1-(4-butylphenyl)-3-[[5-[(3,5-dimethylphenoxy)methyl]furan-2-yl]carbonylamino]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[[5-[(3,5-dimethylphenoxy)methyl]furan-2-yl]carbonylamino]thiourea Openeye Name: 1-(4-butylphenyl)-3-[[5-[(3,5-dimethylphenoxy)methyl]furan-2-carbonyl]amino]thiourea CAS Name: 1-(4-butylphenyl)-3-[[[5-[(3,5-dimethylphenoxy)methyl]-2-furanyl]-oxomethyl]amino]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[[5-[(3,5-dimethylphenoxy)methyl]furan-2-carbonyl]amino]thiourea Traditional Name: 1-(4-butylphenyl)-3-[[5-[(3,5-dimethylphenoxy)methyl]-2-furoyl]amino]thiourea Formula: C25H29N3O3S MolecularWeight: 451.58106

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC=C(O2)COC3=CC(=CC(=C3)C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC=C(O2)COC3=CC(=CC(=C3)C)C

InChI

InChI=1S/C25H29N3O3S/c1-4-5-6-19-7-9-20(10-8-19)26-25(32)28-27-24(29)23-12-11-21(31-23)16-30-22-14-17(2)13-18(3)15-22/h7-15H,4-6,16H2,1-3H3,(H,27,29)(H2,26,28,32)