4-tert-butyl-N-[[(2-prop-2-enoxyphenyl)carbonylamino]carbamothioyl]benzamide

Systemtic Name: 4-tert-butyl-N-[[(2-prop-2-enoxyphenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: N-[[(2-allyloxybenzoyl)amino]carbamothioyl]-4-tert-butyl-benzamide CAS Name: 4-tert-butyl-N-[[[oxo-(2-prop-2-enoxyphenyl)methyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-tert-butyl-N-[[(2-prop-2-enoxybenzoyl)amino]carbamothioyl]benzamide Traditional Name: N-[[(2-allyloxybenzoyl)amino]thiocarbamoyl]-4-tert-butyl-benzamide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=CC=C2OCC=C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=CC=C2OCC=C

InChI

InChI=1S/C22H25N3O3S/c1-5-14-28-18-9-7-6-8-17(18)20(27)24-25-21(29)23-19(26)15-10-12-16(13-11-15)22(2,3)4/h5-13H,1,14H2,2-4H3,(H,24,27)(H2,23,25,26,29)