N-[(3-chloranyl-2-methyl-phenyl)carbamothioyl]-2-(4-nitrophenoxy)ethanamide

Systemtic Name: N-[(3-chloranyl-2-methyl-phenyl)carbamothioyl]-2-(4-nitrophenoxy)ethanamide Openeye Name: N-[(3-chloro-2-methyl-phenyl)carbamothioyl]-2-(4-nitrophenoxy)acetamide CAS Name: N-[(3-chloro-2-methylanilino)-sulfanylidenemethyl]-2-(4-nitrophenoxy)acetamide IUPAC Name: N-[(3-chloro-2-methylphenyl)carbamothioyl]-2-(4-nitrophenoxy)acetamide Traditional Name: N-[(3-chloro-2-methyl-phenyl)thiocarbamoyl]-2-(4-nitrophenoxy)acetamide Formula: C16H14ClN3O4S MolecularWeight: 379.81806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)NC(=O)COC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)NC(=O)COC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H14ClN3O4S/c1-10-13(17)3-2-4-14(10)18-16(25)19-15(21)9-24-12-7-5-11(6-8-12)20(22)23/h2-8H,9H2,1H3,(H2,18,19,21,25)