N-[(4-chloranyl-2-nitro-phenyl)carbamothioyl]-4-(2-methoxyethoxy)benzamide

Systemtic Name: N-[(4-chloranyl-2-nitro-phenyl)carbamothioyl]-4-(2-methoxyethoxy)benzamide Openeye Name: N-[(4-chloro-2-nitro-phenyl)carbamothioyl]-4-(2-methoxyethoxy)benzamide CAS Name: N-[(4-chloro-2-nitroanilino)-sulfanylidenemethyl]-4-(2-methoxyethoxy)benzamide IUPAC Name: N-[(4-chloro-2-nitrophenyl)carbamothioyl]-4-(2-methoxyethoxy)benzamide Traditional Name: N-[(4-chloro-2-nitro-phenyl)thiocarbamoyl]-4-(2-methoxyethoxy)benzamide Formula: C17H16ClN3O5S MolecularWeight: 409.84404

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

COCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H16ClN3O5S/c1-25-8-9-26-13-5-2-11(3-6-13)16(22)20-17(27)19-14-7-4-12(18)10-15(14)21(23)24/h2-7,10H,8-9H2,1H3,(H2,19,20,22,27)