2-[[5-(tert-butylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[5-(tert-butylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 2-[[5-(tert-butylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 2-[[[5-(tert-butylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[5-(tert-butylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 2-[[[5-(tert-butylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]-1H-quinazolin-4-one Formula: C15H17N5OS2 MolecularWeight: 347.45838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=NN=C(S1)SCC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CC(C)(C)NC1=NN=C(S1)SCC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C15H17N5OS2/c1-15(2,3)18-13-19-20-14(23-13)22-8-11-16-10-7-5-4-6-9(10)12(21)17-11/h4-7H,8H2,1-3H3,(H,18,19)(H,16,17,21)