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

Systemtic Name: N-[[2-(2-chloranylphenoxy)ethanoylamino]carbamothioyl]-4-heptoxy-benzamide Openeye Name: N-[[[2-(2-chlorophenoxy)acetyl]amino]carbamothioyl]-4-heptoxy-benzamide CAS Name: N-[[[2-(2-chlorophenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-4-heptoxybenzamide IUPAC Name: N-[[[2-(2-chlorophenoxy)acetyl]amino]carbamothioyl]-4-heptoxybenzamide Traditional Name: N-[[[2-(2-chlorophenoxy)acetyl]amino]thiocarbamoyl]-4-heptoxy-benzamide Formula: C23H28ClN3O4S MolecularWeight: 478.00412

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=CC=CC=C2Cl

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=CC=CC=C2Cl

InChI

InChI=1S/C23H28ClN3O4S/c1-2-3-4-5-8-15-30-18-13-11-17(12-14-18)22(29)25-23(32)27-26-21(28)16-31-20-10-7-6-9-19(20)24/h6-7,9-14H,2-5,8,15-16H2,1H3,(H,26,28)(H2,25,27,29,32)