[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-(1,2,3-thiadiazol-4-yl)methanone

Systemtic Name: [4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-(1,2,3-thiadiazol-4-yl)methanone Openeye Name: [4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-(thiadiazol-4-yl)methanone CAS Name: [4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1-piperazinyl]-(4-thiadiazolyl)methanone IUPAC Name: [4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(thiadiazol-4-yl)methanone Traditional Name: [4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazino]-(thiadiazol-4-yl)methanone Formula: C17H19N7O3S MolecularWeight: 401.44286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)C4=CSN=N4)N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)C4=CSN=N4)N)OC

InChI

InChI=1S/C17H19N7O3S/c1-26-13-7-10-11(8-14(13)27-2)19-17(20-15(10)18)24-5-3-23(4-6-24)16(25)12-9-28-22-21-12/h7-9H,3-6H2,1-2H3,(H2,18,19,20)