2-[[ethyl-[(5-propylsulfanyl-2-sulfanylidene-1,3,4-thiadiazol-3-yl)methyl]amino]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[ethyl-[(5-propylsulfanyl-2-sulfanylidene-1,3,4-thiadiazol-3-yl)methyl]amino]methyl]-1H-quinazolin-4-one Openeye Name: 2-[[ethyl-[(5-propylsulfanyl-2-thioxo-1,3,4-thiadiazol-3-yl)methyl]amino]methyl]-1H-quinazolin-4-one CAS Name: 2-[[ethyl-[[5-(propylthio)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl]amino]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[ethyl-[(5-propylsulfanyl-2-sulfanylidene-1,3,4-thiadiazol-3-yl)methyl]amino]methyl]-1H-quinazolin-4-one Traditional Name: 2-[[ethyl-[[5-(propylthio)-2-thioxo-1,3,4-thiadiazol-3-yl]methyl]amino]methyl]-1H-quinazolin-4-one Formula: C17H21N5OS3 MolecularWeight: 407.57654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN(C(=S)S1)CN(CC)CC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CCCSC1=NN(C(=S)S1)CN(CC)CC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C17H21N5OS3/c1-3-9-25-16-20-22(17(24)26-16)11-21(4-2)10-14-18-13-8-6-5-7-12(13)15(23)19-14/h5-8H,3-4,9-11H2,1-2H3,(H,18,19,23)