4-chloranyl-N-[5-[(6-methyl-4-oxidanylidene-1H-quinolin-2-yl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 4-chloranyl-N-[5-[(6-methyl-4-oxidanylidene-1H-quinolin-2-yl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 4-chloro-N-[5-[(6-methyl-4-oxo-1H-quinolin-2-yl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 4-chloro-N-[5-[(6-methyl-4-oxo-1H-quinolin-2-yl)methylthio]-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 4-chloro-N-[5-[(6-methyl-4-oxo-1H-quinolin-2-yl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 4-chloro-N-[5-[(4-keto-6-methyl-1H-quinolin-2-yl)methylthio]-1,3,4-thiadiazol-2-yl]benzamide Formula: C20H15ClN4O2S2 MolecularWeight: 442.9417

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=CC2=O)CSC3=NN=C(S3)NC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=CC2=O)CSC3=NN=C(S3)NC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H15ClN4O2S2/c1-11-2-7-16-15(8-11)17(26)9-14(22-16)10-28-20-25-24-19(29-20)23-18(27)12-3-5-13(21)6-4-12/h2-9H,10H2,1H3,(H,22,26)(H,23,24,27)