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

Systemtic Name: N-[4-[[3-chloranyl-4-(methylsulfonylamino)phenyl]carbamothioylamino]phenyl]ethanamide Openeye Name: N-[4-[[3-chloro-4-(methanesulfonamido)phenyl]carbamothioylamino]phenyl]acetamide CAS Name: N-[4-[[[3-chloro-4-(methanesulfonamido)anilino]-sulfanylidenemethyl]amino]phenyl]acetamide IUPAC Name: N-[4-[[3-chloro-4-(methanesulfonamido)phenyl]carbamothioylamino]phenyl]acetamide Traditional Name: N-[4-[[3-chloro-4-(methanesulfonamido)phenyl]thiocarbamoylamino]phenyl]acetamide Formula: C16H17ClN4O3S2 MolecularWeight: 412.91418

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=S)NC2=CC(=C(C=C2)NS(=O)(=O)C)Cl

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=S)NC2=CC(=C(C=C2)NS(=O)(=O)C)Cl

InChI

InChI=1S/C16H17ClN4O3S2/c1-10(22)18-11-3-5-12(6-4-11)19-16(25)20-13-7-8-15(14(17)9-13)21-26(2,23)24/h3-9,21H,1-2H3,(H,18,22)(H2,19,20,25)