4-chloranyl-N-[5-(3-ethyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-2-methyl-phenyl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[5-(3-ethyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-2-methyl-phenyl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[5-(3-ethyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-2-methyl-phenyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[5-(3-ethyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-2-methylphenyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[5-(3-ethyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-2-methylphenyl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[5-(3-ethyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-2-methyl-phenyl]-3-nitro-benzamide Formula: C19H15ClN6O3S MolecularWeight: 442.8788

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C2N1N=C(S2)C3=CC(=C(C=C3)C)NC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CCC1=NN=C2N1N=C(S2)C3=CC(=C(C=C3)C)NC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H15ClN6O3S/c1-3-16-22-23-19-25(16)24-18(30-19)12-5-4-10(2)14(8-12)21-17(27)11-6-7-13(20)15(9-11)26(28)29/h4-9H,3H2,1-2H3,(H,21,27)