1-(4-chloranyl-2,5-dimethoxy-phenyl)-3-[(3,4,5-triethoxyphenyl)carbonylamino]thiourea

Systemtic Name: 1-(4-chloranyl-2,5-dimethoxy-phenyl)-3-[(3,4,5-triethoxyphenyl)carbonylamino]thiourea Openeye Name: 1-(4-chloro-2,5-dimethoxy-phenyl)-3-[(3,4,5-triethoxybenzoyl)amino]thiourea CAS Name: 1-(4-chloro-2,5-dimethoxyphenyl)-3-[[oxo-(3,4,5-triethoxyphenyl)methyl]amino]thiourea IUPAC Name: 1-(4-chloro-2,5-dimethoxyphenyl)-3-[(3,4,5-triethoxybenzoyl)amino]thiourea Traditional Name: 1-(4-chloro-2,5-dimethoxy-phenyl)-3-[(3,4,5-triethoxybenzoyl)amino]thiourea Formula: C22H28ClN3O6S MolecularWeight: 497.99222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NNC(=S)NC2=CC(=C(C=C2OC)Cl)OC

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NNC(=S)NC2=CC(=C(C=C2OC)Cl)OC

InChI

InChI=1S/C22H28ClN3O6S/c1-6-30-18-9-13(10-19(31-7-2)20(18)32-8-3)21(27)25-26-22(33)24-15-12-16(28-4)14(23)11-17(15)29-5/h9-12H,6-8H2,1-5H3,(H,25,27)(H2,24,26,33)