1-[2-(2-bromanyl-4-tert-butyl-phenoxy)ethanoylamino]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[2-(2-bromanyl-4-tert-butyl-phenoxy)ethanoylamino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[[2-(2-bromo-4-tert-butyl-phenoxy)acetyl]amino]thiourea CAS Name: 1-[[2-(2-bromo-4-tert-butylphenoxy)-1-oxoethyl]amino]-3-prop-2-enylthiourea IUPAC Name: 1-[[2-(2-bromo-4-tert-butylphenoxy)acetyl]amino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[[2-(2-bromo-4-tert-butyl-phenoxy)acetyl]amino]thiourea Formula: C16H22BrN3O2S MolecularWeight: 400.33378

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OCC(=O)NNC(=S)NCC=C)Br

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OCC(=O)NNC(=S)NCC=C)Br

InChI

InChI=1S/C16H22BrN3O2S/c1-5-8-18-15(23)20-19-14(21)10-22-13-7-6-11(9-12(13)17)16(2,3)4/h5-7,9H,1,8,10H2,2-4H3,(H,19,21)(H2,18,20,23)