N-[4-[[3-chloranyl-4-(cyanomethoxy)phenyl]carbamothioylamino]phenyl]ethanamide

Systemtic Name: N-[4-[[3-chloranyl-4-(cyanomethoxy)phenyl]carbamothioylamino]phenyl]ethanamide Openeye Name: N-[4-[[3-chloro-4-(cyanomethoxy)phenyl]carbamothioylamino]phenyl]acetamide CAS Name: N-[4-[[[3-chloro-4-(cyanomethoxy)anilino]-sulfanylidenemethyl]amino]phenyl]acetamide IUPAC Name: N-[4-[[3-chloro-4-(cyanomethoxy)phenyl]carbamothioylamino]phenyl]acetamide Traditional Name: N-[4-[[3-chloro-4-(cyanomethoxy)phenyl]thiocarbamoylamino]phenyl]acetamide Formula: C17H15ClN4O2S MolecularWeight: 374.8446

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=S)NC2=CC(=C(C=C2)OCC#N)Cl

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=S)NC2=CC(=C(C=C2)OCC#N)Cl

InChI

InChI=1S/C17H15ClN4O2S/c1-11(23)20-12-2-4-13(5-3-12)21-17(25)22-14-6-7-16(15(18)10-14)24-9-8-19/h2-7,10H,9H2,1H3,(H,20,23)(H2,21,22,25)