4-heptoxy-N-[[2-(3-methylphenoxy)ethanoylamino]carbamothioyl]benzamide

Systemtic Name: 4-heptoxy-N-[[2-(3-methylphenoxy)ethanoylamino]carbamothioyl]benzamide Openeye Name: 4-heptoxy-N-[[[2-(3-methylphenoxy)acetyl]amino]carbamothioyl]benzamide CAS Name: 4-heptoxy-N-[[[2-(3-methylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-heptoxy-N-[[[2-(3-methylphenoxy)acetyl]amino]carbamothioyl]benzamide Traditional Name: 4-heptoxy-N-[[[2-(3-methylphenoxy)acetyl]amino]thiocarbamoyl]benzamide Formula: C24H31N3O4S MolecularWeight: 457.58564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=CC=CC(=C2)C

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=CC=CC(=C2)C

InChI

InChI=1S/C24H31N3O4S/c1-3-4-5-6-7-15-30-20-13-11-19(12-14-20)23(29)25-24(32)27-26-22(28)17-31-21-10-8-9-18(2)16-21/h8-14,16H,3-7,15,17H2,1-2H3,(H,26,28)(H2,25,27,29,32)