5-[(4-methyl-3-oxidanidyl-2,3-dihydroquinazolin-3-ium-2-yl)methylsulfanyl]-3H-1,3,4-thiadiazole-2-thione

Systemtic Name: 5-[(4-methyl-3-oxidanidyl-2,3-dihydroquinazolin-3-ium-2-yl)methylsulfanyl]-3H-1,3,4-thiadiazole-2-thione Openeye Name: 5-[(4-methyl-3-oxido-2,3-dihydroquinazolin-3-ium-2-yl)methylsulfanyl]-3H-1,3,4-thiadiazole-2-thione CAS Name: 5-[(4-methyl-3-oxido-2,3-dihydroquinazolin-3-ium-2-yl)methylthio]-3H-1,3,4-thiadiazole-2-thione IUPAC Name: 5-[(4-methyl-3-oxido-2,3-dihydroquinazolin-3-ium-2-yl)methylsulfanyl]-3H-1,3,4-thiadiazole-2-thione Traditional Name: 5-[(4-methyl-3-oxido-2,3-dihydroquinazolin-3-ium-2-yl)methylthio]-3H-1,3,4-thiadiazole-2-thione Formula: C12H12N4OS3 MolecularWeight: 324.44488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC=CC2=NC([NH+]1[O-])CSC3=NNC(=S)S3

Isomeric SMILES

CC1=C2C=CC=CC2=NC([NH+]1[O-])CSC3=NNC(=S)S3

InChI

InChI=1S/C12H12N4OS3/c1-7-8-4-2-3-5-9(8)13-10(16(7)17)6-19-12-15-14-11(18)20-12/h2-5,10,16H,6H2,1H3,(H,14,18)