3-[2-(cyclohexen-1-yl)ethyl]-7-morpholin-4-ylcarbonyl-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-[2-(cyclohexen-1-yl)ethyl]-7-morpholin-4-ylcarbonyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-[2-(cyclohexen-1-yl)ethyl]-7-(morpholine-4-carbonyl)-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[2-(1-cyclohexenyl)ethyl]-7-[4-morpholinyl(oxo)methyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-[2-(cyclohexen-1-yl)ethyl]-7-(morpholine-4-carbonyl)-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-[2-(cyclohexen-1-yl)ethyl]-7-(morpholine-4-carbonyl)-2-thioxo-1H-quinazolin-4-one Formula: C21H25N3O3S MolecularWeight: 399.5065

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCN2C(=O)C3=C(C=C(C=C3)C(=O)N4CCOCC4)NC2=S

Isomeric SMILES

C1CCC(=CC1)CCN2C(=O)C3=C(C=C(C=C3)C(=O)N4CCOCC4)NC2=S

InChI

InChI=1S/C21H25N3O3S/c25-19(23-10-12-27-13-11-23)16-6-7-17-18(14-16)22-21(28)24(20(17)26)9-8-15-4-2-1-3-5-15/h4,6-7,14H,1-3,5,8-13H2,(H,22,28)