1-(4-ethanoylphenyl)-3-[(3,4,5-triethoxyphenyl)carbonylamino]thiourea

Systemtic Name: 1-(4-ethanoylphenyl)-3-[(3,4,5-triethoxyphenyl)carbonylamino]thiourea Openeye Name: 1-(4-acetylphenyl)-3-[(3,4,5-triethoxybenzoyl)amino]thiourea CAS Name: 1-(4-acetylphenyl)-3-[[oxo-(3,4,5-triethoxyphenyl)methyl]amino]thiourea IUPAC Name: 1-(4-acetylphenyl)-3-[(3,4,5-triethoxybenzoyl)amino]thiourea Traditional Name: 1-(4-acetylphenyl)-3-[(3,4,5-triethoxybenzoyl)amino]thiourea Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NNC(=S)NC2=CC=C(C=C2)C(=O)C

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NNC(=S)NC2=CC=C(C=C2)C(=O)C

InChI

InChI=1S/C22H27N3O5S/c1-5-28-18-12-16(13-19(29-6-2)20(18)30-7-3)21(27)24-25-22(31)23-17-10-8-15(9-11-17)14(4)26/h8-13H,5-7H2,1-4H3,(H,24,27)(H2,23,25,31)