N-[5-(7-chloranylquinolin-4-yl)sulfanyl-1,3,4-thiadiazol-2-yl]-5-methyl-2-phenyl-1,2,3-triazole-4-carboxamide

Systemtic Name: N-[5-(7-chloranylquinolin-4-yl)sulfanyl-1,3,4-thiadiazol-2-yl]-5-methyl-2-phenyl-1,2,3-triazole-4-carboxamide Openeye Name: N-[5-[(7-chloro-4-quinolyl)sulfanyl]-1,3,4-thiadiazol-2-yl]-5-methyl-2-phenyl-triazole-4-carboxamide CAS Name: N-[5-[(7-chloro-4-quinolinyl)thio]-1,3,4-thiadiazol-2-yl]-5-methyl-2-phenyl-4-triazolecarboxamide IUPAC Name: N-[5-(7-chloroquinolin-4-yl)sulfanyl-1,3,4-thiadiazol-2-yl]-5-methyl-2-phenyltriazole-4-carboxamide Traditional Name: N-[5-[(7-chloro-4-quinolyl)thio]-1,3,4-thiadiazol-2-yl]-5-methyl-2-phenyl-triazole-4-carboxamide Formula: C21H14ClN7OS2 MolecularWeight: 479.96516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)NC2=NN=C(S2)SC3=C4C=CC(=CC4=NC=C3)Cl)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(N=C1C(=O)NC2=NN=C(S2)SC3=C4C=CC(=CC4=NC=C3)Cl)C5=CC=CC=C5

InChI

InChI=1S/C21H14ClN7OS2/c1-12-18(28-29(27-12)14-5-3-2-4-6-14)19(30)24-20-25-26-21(32-20)31-17-9-10-23-16-11-13(22)7-8-15(16)17/h2-11H,1H3,(H,24,25,30)