N-(4-phenylazanylphenyl)-2-(propanoylcarbamothioylamino)benzamide

Systemtic Name: N-(4-phenylazanylphenyl)-2-(propanoylcarbamothioylamino)benzamide Openeye Name: N-(4-anilinophenyl)-2-(propanoylcarbamothioylamino)benzamide CAS Name: N-(4-anilinophenyl)-2-[[(1-oxopropylamino)-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(4-anilinophenyl)-2-(propanoylcarbamothioylamino)benzamide Traditional Name: N-(4-anilinophenyl)-2-(propionylthiocarbamoylamino)benzamide Formula: C23H22N4O2S MolecularWeight: 418.51138

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(=S)NC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)NC3=CC=CC=C3

Isomeric SMILES

CCC(=O)NC(=S)NC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)NC3=CC=CC=C3

InChI

InChI=1S/C23H22N4O2S/c1-2-21(28)27-23(30)26-20-11-7-6-10-19(20)22(29)25-18-14-12-17(13-15-18)24-16-8-4-3-5-9-16/h3-15,24H,2H2,1H3,(H,25,29)(H2,26,27,28,30)