3-chloranyl-N-[2-[(4-nitrophenyl)amino]ethylcarbamothioyl]benzamide

Systemtic Name: 3-chloranyl-N-[2-[(4-nitrophenyl)amino]ethylcarbamothioyl]benzamide Openeye Name: 3-chloro-N-[2-(4-nitroanilino)ethylcarbamothioyl]benzamide CAS Name: 3-chloro-N-[[2-(4-nitroanilino)ethylamino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-chloro-N-[2-(4-nitroanilino)ethylcarbamothioyl]benzamide Traditional Name: 3-chloro-N-[2-(4-nitroanilino)ethylthiocarbamoyl]benzamide Formula: C16H15ClN4O3S MolecularWeight: 378.8333

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C(=O)NC(=S)NCCNC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C(=O)NC(=S)NCCNC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H15ClN4O3S/c17-12-3-1-2-11(10-12)15(22)20-16(25)19-9-8-18-13-4-6-14(7-5-13)21(23)24/h1-7,10,18H,8-9H2,(H2,19,20,22,25)