N-(4-tert-butylphenyl)-2-[3-(3-methylpyridin-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: N-(4-tert-butylphenyl)-2-[3-(3-methylpyridin-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide Openeye Name: N-(4-tert-butylphenyl)-2-[3-(3-methyl-2-pyridyl)-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: N-(4-tert-butylphenyl)-2-[[3-(3-methyl-2-pyridinyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: N-(4-tert-butylphenyl)-2-[3-(3-methylpyridin-2-yl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: N-(4-tert-butylphenyl)-2-[[4-keto-3-(3-methyl-2-pyridyl)quinazolin-2-yl]thio]propionamide Formula: C27H28N4O2S MolecularWeight: 472.60182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NC4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=C(N=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NC4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C27H28N4O2S/c1-17-9-8-16-28-23(17)31-25(33)21-10-6-7-11-22(21)30-26(31)34-18(2)24(32)29-20-14-12-19(13-15-20)27(3,4)5/h6-16,18H,1-5H3,(H,29,32)