4-chloranyl-N-(3,4-dihydro-2H-quinolin-1-ylcarbothioyl)-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-(3,4-dihydro-2H-quinolin-1-ylcarbothioyl)-3-nitro-benzamide Openeye Name: 4-chloro-N-(3,4-dihydro-2H-quinoline-1-carbothioyl)-3-nitro-benzamide CAS Name: 4-chloro-N-[3,4-dihydro-2H-quinolin-1-yl(sulfanylidene)methyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-(3,4-dihydro-2H-quinoline-1-carbothioyl)-3-nitrobenzamide Traditional Name: 4-chloro-N-(3,4-dihydro-2H-quinoline-1-carbothioyl)-3-nitro-benzamide Formula: C17H14ClN3O3S MolecularWeight: 375.82936

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)C(=S)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)C(=S)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H14ClN3O3S/c18-13-8-7-12(10-15(13)21(23)24)16(22)19-17(25)20-9-3-5-11-4-1-2-6-14(11)20/h1-2,4,6-8,10H,3,5,9H2,(H,19,22,25)