4-chloranyl-N-[methyl-(phenylmethyl)carbamothioyl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[methyl-(phenylmethyl)carbamothioyl]-3-nitro-benzamide Openeye Name: N-[benzyl(methyl)carbamothioyl]-4-chloro-3-nitro-benzamide CAS Name: 4-chloro-N-[[methyl-(phenylmethyl)amino]-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: N-[benzyl(methyl)carbamothioyl]-4-chloro-3-nitrobenzamide Traditional Name: N-[benzyl(methyl)thiocarbamoyl]-4-chloro-3-nitro-benzamide Formula: C16H14ClN3O3S MolecularWeight: 363.81866

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=S)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=S)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H14ClN3O3S/c1-19(10-11-5-3-2-4-6-11)16(24)18-15(21)12-7-8-13(17)14(9-12)20(22)23/h2-9H,10H2,1H3,(H,18,21,24)