2-methyl-3-nitro-N-(quinolin-5-ylcarbamothioyl)benzamide

Systemtic Name: 2-methyl-3-nitro-N-(quinolin-5-ylcarbamothioyl)benzamide Openeye Name: 2-methyl-3-nitro-N-(5-quinolylcarbamothioyl)benzamide CAS Name: 2-methyl-3-nitro-N-[(5-quinolinylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 2-methyl-3-nitro-N-(quinolin-5-ylcarbamothioyl)benzamide Traditional Name: 2-methyl-3-nitro-N-(5-quinolylthiocarbamoyl)benzamide Formula: C18H14N4O3S MolecularWeight: 366.39376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC(=S)NC2=CC=CC3=C2C=CC=N3

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC(=S)NC2=CC=CC3=C2C=CC=N3

InChI

InChI=1S/C18H14N4O3S/c1-11-12(5-2-9-16(11)22(24)25)17(23)21-18(26)20-15-8-3-7-14-13(15)6-4-10-19-14/h2-10H,1H3,(H2,20,21,23,26)