1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(2-oxidanyl-2,2-diphenyl-ethanoyl)amino]thiourea

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(2-oxidanyl-2,2-diphenyl-ethanoyl)amino]thiourea Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(2-hydroxy-2,2-diphenyl-acetyl)amino]thiourea CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(2-hydroxy-1-oxo-2,2-diphenylethyl)amino]thiourea IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(2-hydroxy-2,2-diphenylacetyl)amino]thiourea Traditional Name: 1-(benziloylamino)-3-homoveratryl-thiourea Formula: C25H27N3O4S MolecularWeight: 465.56458

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=S)NNC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=S)NNC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O)OC

InChI

InChI=1S/C25H27N3O4S/c1-31-21-14-13-18(17-22(21)32-2)15-16-26-24(33)28-27-23(29)25(30,19-9-5-3-6-10-19)20-11-7-4-8-12-20/h3-14,17,30H,15-16H2,1-2H3,(H,27,29)(H2,26,28,33)