4-propan-2-yl-N-[[(2-prop-2-enoxyphenyl)carbonylamino]carbamothioyl]benzamide

Systemtic Name: 4-propan-2-yl-N-[[(2-prop-2-enoxyphenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: N-[[(2-allyloxybenzoyl)amino]carbamothioyl]-4-isopropyl-benzamide CAS Name: N-[[[oxo-(2-prop-2-enoxyphenyl)methyl]hydrazo]-sulfanylidenemethyl]-4-propan-2-ylbenzamide IUPAC Name: 4-propan-2-yl-N-[[(2-prop-2-enoxybenzoyl)amino]carbamothioyl]benzamide Traditional Name: N-[[(2-allyloxybenzoyl)amino]thiocarbamoyl]-4-isopropyl-benzamide Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O3S/c1-4-13-27-18-8-6-5-7-17(18)20(26)23-24-21(28)22-19(25)16-11-9-15(10-12-16)14(2)3/h4-12,14H,1,13H2,2-3H3,(H,23,26)(H2,22,24,25,28)