2-(cyanomethylsulfanyl)-N-[4-(phenylcarbamoylamino)phenyl]benzamide

Systemtic Name: 2-(cyanomethylsulfanyl)-N-[4-(phenylcarbamoylamino)phenyl]benzamide Openeye Name: 2-(cyanomethylsulfanyl)-N-[4-(phenylcarbamoylamino)phenyl]benzamide CAS Name: N-[4-[[anilino(oxo)methyl]amino]phenyl]-2-(cyanomethylthio)benzamide IUPAC Name: 2-(cyanomethylsulfanyl)-N-[4-(phenylcarbamoylamino)phenyl]benzamide Traditional Name: 2-(cyanomethylthio)-N-[4-(phenylcarbamoylamino)phenyl]benzamide Formula: C22H18N4O2S MolecularWeight: 402.46892

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3SCC#N

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3SCC#N

InChI

InChI=1S/C22H18N4O2S/c23-14-15-29-20-9-5-4-8-19(20)21(27)24-17-10-12-18(13-11-17)26-22(28)25-16-6-2-1-3-7-16/h1-13H,15H2,(H,24,27)(H2,25,26,28)