4-heptoxy-N-[[(3-methylphenyl)carbonylamino]carbamothioyl]benzamide

Systemtic Name: 4-heptoxy-N-[[(3-methylphenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: 4-heptoxy-N-[[(3-methylbenzoyl)amino]carbamothioyl]benzamide CAS Name: 4-heptoxy-N-[[[(3-methylphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-heptoxy-N-[[(3-methylbenzoyl)amino]carbamothioyl]benzamide Traditional Name: 4-heptoxy-N-[(m-toluoylamino)thiocarbamoyl]benzamide Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29N3O3S/c1-3-4-5-6-7-15-29-20-13-11-18(12-14-20)21(27)24-23(30)26-25-22(28)19-10-8-9-17(2)16-19/h8-14,16H,3-7,15H2,1-2H3,(H,25,28)(H2,24,26,27,30)