2-chloranyl-5-nitro-N-[2-(pyridin-4-ylcarbamothioylamino)phenyl]benzamide

Systemtic Name: 2-chloranyl-5-nitro-N-[2-(pyridin-4-ylcarbamothioylamino)phenyl]benzamide Openeye Name: 2-chloro-5-nitro-N-[2-(4-pyridylcarbamothioylamino)phenyl]benzamide CAS Name: 2-chloro-5-nitro-N-[2-[[(pyridin-4-ylamino)-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: 2-chloro-5-nitro-N-[2-(pyridin-4-ylcarbamothioylamino)phenyl]benzamide Traditional Name: 2-chloro-5-nitro-N-[2-(4-pyridylthiocarbamoylamino)phenyl]benzamide Formula: C19H14ClN5O3S MolecularWeight: 427.86416

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl)NC(=S)NC3=CC=NC=C3

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl)NC(=S)NC3=CC=NC=C3

InChI

InChI=1S/C19H14ClN5O3S/c20-15-6-5-13(25(27)28)11-14(15)18(26)23-16-3-1-2-4-17(16)24-19(29)22-12-7-9-21-10-8-12/h1-11H,(H,23,26)(H2,21,22,24,29)