2-cyclopropyl-5-(6,7-dimethoxy-2-phenyl-quinazolin-4-yl)sulfanyl-1,3,4-oxadiazole

Systemtic Name: 2-cyclopropyl-5-(6,7-dimethoxy-2-phenyl-quinazolin-4-yl)sulfanyl-1,3,4-oxadiazole Openeye Name: 2-cyclopropyl-5-(6,7-dimethoxy-2-phenyl-quinazolin-4-yl)sulfanyl-1,3,4-oxadiazole CAS Name: 2-cyclopropyl-5-[(6,7-dimethoxy-2-phenyl-4-quinazolinyl)thio]-1,3,4-oxadiazole IUPAC Name: 2-cyclopropyl-5-(6,7-dimethoxy-2-phenylquinazolin-4-yl)sulfanyl-1,3,4-oxadiazole Traditional Name: 2-cyclopropyl-5-[(6,7-dimethoxy-2-phenyl-quinazolin-4-yl)thio]-1,3,4-oxadiazole Formula: C21H18N4O3S MolecularWeight: 406.45762

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)C3=CC=CC=C3)SC4=NN=C(O4)C5CC5)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)C3=CC=CC=C3)SC4=NN=C(O4)C5CC5)OC

InChI

InChI=1S/C21H18N4O3S/c1-26-16-10-14-15(11-17(16)27-2)22-18(12-6-4-3-5-7-12)23-20(14)29-21-25-24-19(28-21)13-8-9-13/h3-7,10-11,13H,8-9H2,1-2H3