N-[4-[(2-chloranyl-4-nitro-phenyl)carbamothioylamino]phenyl]-N-methyl-ethanamide

Systemtic Name: N-[4-[(2-chloranyl-4-nitro-phenyl)carbamothioylamino]phenyl]-N-methyl-ethanamide Openeye Name: N-[4-[(2-chloro-4-nitro-phenyl)carbamothioylamino]phenyl]-N-methyl-acetamide CAS Name: N-[4-[[(2-chloro-4-nitroanilino)-sulfanylidenemethyl]amino]phenyl]-N-methylacetamide IUPAC Name: N-[4-[(2-chloro-4-nitrophenyl)carbamothioylamino]phenyl]-N-methylacetamide Traditional Name: N-[4-[(2-chloro-4-nitro-phenyl)thiocarbamoylamino]phenyl]-N-methyl-acetamide Formula: C16H15ClN4O3S MolecularWeight: 378.8333

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C)C1=CC=C(C=C1)NC(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CC(=O)N(C)C1=CC=C(C=C1)NC(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H15ClN4O3S/c1-10(22)20(2)12-5-3-11(4-6-12)18-16(25)19-15-8-7-13(21(23)24)9-14(15)17/h3-9H,1-2H3,(H2,18,19,25)