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

Systemtic Name: 4-heptoxy-N-[[(2-prop-2-enoxyphenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: N-[[(2-allyloxybenzoyl)amino]carbamothioyl]-4-heptoxy-benzamide CAS Name: 4-heptoxy-N-[[[oxo-(2-prop-2-enoxyphenyl)methyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-heptoxy-N-[[(2-prop-2-enoxybenzoyl)amino]carbamothioyl]benzamide Traditional Name: N-[[(2-allyloxybenzoyl)amino]thiocarbamoyl]-4-heptoxy-benzamide Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=CC=C2OCC=C

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=CC=C2OCC=C

InChI

InChI=1S/C25H31N3O4S/c1-3-5-6-7-10-18-31-20-15-13-19(14-16-20)23(29)26-25(33)28-27-24(30)21-11-8-9-12-22(21)32-17-4-2/h4,8-9,11-16H,2-3,5-7,10,17-18H2,1H3,(H,27,30)(H2,26,28,29,33)