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

Systemtic Name: 3-methyl-N-[5-[(6-methyl-4-oxidanylidene-1H-quinolin-2-yl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 3-methyl-N-[5-[(6-methyl-4-oxo-1H-quinolin-2-yl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 3-methyl-N-[5-[(6-methyl-4-oxo-1H-quinolin-2-yl)methylthio]-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 3-methyl-N-[5-[(6-methyl-4-oxo-1H-quinolin-2-yl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: N-[5-[(4-keto-6-methyl-1H-quinolin-2-yl)methylthio]-1,3,4-thiadiazol-2-yl]-3-methyl-benzamide Formula: C21H18N4O2S2 MolecularWeight: 422.52322

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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(=CC=C4)C

Isomeric SMILES

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

InChI

InChI=1S/C21H18N4O2S2/c1-12-4-3-5-14(8-12)19(27)23-20-24-25-21(29-20)28-11-15-10-18(26)16-9-13(2)6-7-17(16)22-15/h3-10H,11H2,1-2H3,(H,22,26)(H,23,24,27)