7-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylcarbonyl)-3-(furan-2-ylmethyl)-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 7-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylcarbonyl)-3-(furan-2-ylmethyl)-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 7-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-3-(2-furylmethyl)-2-thioxo-1H-quinazolin-4-one CAS Name: 7-[1,4-dioxa-8-azaspiro[4.5]decan-8-yl(oxo)methyl]-3-(2-furanylmethyl)-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 7-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-3-(furan-2-ylmethyl)-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 7-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-3-(2-furfuryl)-2-thioxo-1H-quinazolin-4-one Formula: C21H21N3O5S MolecularWeight: 427.47354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12OCCO2)C(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)CC5=CC=CO5

Isomeric SMILES

C1CN(CCC12OCCO2)C(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)CC5=CC=CO5

InChI

InChI=1S/C21H21N3O5S/c25-18(23-7-5-21(6-8-23)28-10-11-29-21)14-3-4-16-17(12-14)22-20(30)24(19(16)26)13-15-2-1-9-27-15/h1-4,9,12H,5-8,10-11,13H2,(H,22,30)