3-(4-tert-butylphenyl)-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-(4-tert-butylphenyl)-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-(4-tert-butylphenyl)-2-thioxo-1H-quinazolin-4-one CAS Name: 3-(4-tert-butylphenyl)-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-(4-tert-butylphenyl)-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-(4-tert-butylphenyl)-2-thioxo-1H-quinazolin-4-one Formula: C18H18N2OS MolecularWeight: 310.41332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3NC2=S

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3NC2=S

InChI

InChI=1S/C18H18N2OS/c1-18(2,3)12-8-10-13(11-9-12)20-16(21)14-6-4-5-7-15(14)19-17(20)22/h4-11H,1-3H3,(H,19,22)