1-(5-tert-butyl-1,2-oxazol-3-yl)-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea

Systemtic Name: 1-(5-tert-butyl-1,2-oxazol-3-yl)-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea Openeye Name: 1-(5-tert-butylisoxazol-3-yl)-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea CAS Name: 1-(5-tert-butyl-3-isoxazolyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea IUPAC Name: 1-(5-tert-butyl-1,2-oxazol-3-yl)-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea Traditional Name: 1-(5-tert-butylisoxazol-3-yl)-3-homoveratryl-thiourea Formula: C18H25N3O3S MolecularWeight: 363.4744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NO1)NC(=S)NCCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(C)(C)C1=CC(=NO1)NC(=S)NCCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C18H25N3O3S/c1-18(2,3)15-11-16(21-24-15)20-17(25)19-9-8-12-6-7-13(22-4)14(10-12)23-5/h6-7,10-11H,8-9H2,1-5H3,(H2,19,20,21,25)