2-chloranyl-4-nitro-N-[[3-(pentanoylamino)phenyl]carbamothioyl]benzamide

Systemtic Name: 2-chloranyl-4-nitro-N-[[3-(pentanoylamino)phenyl]carbamothioyl]benzamide Openeye Name: 2-chloro-4-nitro-N-[[3-(pentanoylamino)phenyl]carbamothioyl]benzamide CAS Name: 2-chloro-4-nitro-N-[[3-(1-oxopentylamino)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 2-chloro-4-nitro-N-[[3-(pentanoylamino)phenyl]carbamothioyl]benzamide Traditional Name: 2-chloro-4-nitro-N-[[3-(valerylamino)phenyl]thiocarbamoyl]benzamide Formula: C19H19ClN4O4S MolecularWeight: 434.89656

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CCCCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H19ClN4O4S/c1-2-3-7-17(25)21-12-5-4-6-13(10-12)22-19(29)23-18(26)15-9-8-14(24(27)28)11-16(15)20/h4-6,8-11H,2-3,7H2,1H3,(H,21,25)(H2,22,23,26,29)