N-(4-ethoxyphenyl)-2-(2-propan-2-ylquinazolin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-ethoxyphenyl)-2-(2-propan-2-ylquinazolin-4-yl)sulfanyl-ethanamide Openeye Name: N-(4-ethoxyphenyl)-2-(2-isopropylquinazolin-4-yl)sulfanyl-acetamide CAS Name: N-(4-ethoxyphenyl)-2-[(2-propan-2-yl-4-quinazolinyl)thio]acetamide IUPAC Name: N-(4-ethoxyphenyl)-2-(2-propan-2-ylquinazolin-4-yl)sulfanylacetamide Traditional Name: 2-[(2-isopropylquinazolin-4-yl)thio]-N-p-phenetyl-acetamide Formula: C21H23N3O2S MolecularWeight: 381.49122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CSC2=NC(=NC3=CC=CC=C32)C(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CSC2=NC(=NC3=CC=CC=C32)C(C)C

InChI

InChI=1S/C21H23N3O2S/c1-4-26-16-11-9-15(10-12-16)22-19(25)13-27-21-17-7-5-6-8-18(17)23-20(24-21)14(2)3/h5-12,14H,4,13H2,1-3H3,(H,22,25)