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

Systemtic Name: 2-methyl-N-[5-[(6-methyl-4-oxidanylidene-1H-quinolin-2-yl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 2-methyl-N-[5-[(6-methyl-4-oxo-1H-quinolin-2-yl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 2-methyl-N-[5-[(6-methyl-4-oxo-1H-quinolin-2-yl)methylthio]-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 2-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]-2-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=C4C

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=CC2=O)CSC3=NN=C(S3)NC(=O)C4=CC=CC=C4C

InChI

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