2-chloranyl-N-[5-(7-chloranylquinolin-4-yl)sulfanyl-1,3,4-thiadiazol-2-yl]-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[5-(7-chloranylquinolin-4-yl)sulfanyl-1,3,4-thiadiazol-2-yl]-4-nitro-benzamide Openeye Name: 2-chloro-N-[5-[(7-chloro-4-quinolyl)sulfanyl]-1,3,4-thiadiazol-2-yl]-4-nitro-benzamide CAS Name: 2-chloro-N-[5-[(7-chloro-4-quinolinyl)thio]-1,3,4-thiadiazol-2-yl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-[5-(7-chloroquinolin-4-yl)sulfanyl-1,3,4-thiadiazol-2-yl]-4-nitrobenzamide Traditional Name: 2-chloro-N-[5-[(7-chloro-4-quinolyl)thio]-1,3,4-thiadiazol-2-yl]-4-nitro-benzamide Formula: C18H9Cl2N5O3S2 MolecularWeight: 478.33176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])Cl)C(=O)NC2=NN=C(S2)SC3=C4C=CC(=CC4=NC=C3)Cl

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])Cl)C(=O)NC2=NN=C(S2)SC3=C4C=CC(=CC4=NC=C3)Cl

InChI

InChI=1S/C18H9Cl2N5O3S2/c19-9-1-3-12-14(7-9)21-6-5-15(12)29-18-24-23-17(30-18)22-16(26)11-4-2-10(25(27)28)8-13(11)20/h1-8H,(H,22,23,26)