4-hexoxy-N-[4-(propanoylcarbamothioylamino)phenyl]benzamide

Systemtic Name: 4-hexoxy-N-[4-(propanoylcarbamothioylamino)phenyl]benzamide Openeye Name: 4-hexoxy-N-[4-(propanoylcarbamothioylamino)phenyl]benzamide CAS Name: 4-hexoxy-N-[4-[[(1-oxopropylamino)-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: 4-hexoxy-N-[4-(propanoylcarbamothioylamino)phenyl]benzamide Traditional Name: 4-hexoxy-N-[4-(propionylthiocarbamoylamino)phenyl]benzamide Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)CC

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)CC

InChI

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