N-[4-[2-(2-propan-2-ylquinazolin-4-yl)sulfanylethanoyl]phenyl]ethanamide

Systemtic Name: N-[4-[2-(2-propan-2-ylquinazolin-4-yl)sulfanylethanoyl]phenyl]ethanamide Openeye Name: N-[4-[2-(2-isopropylquinazolin-4-yl)sulfanylacetyl]phenyl]acetamide CAS Name: N-[4-[1-oxo-2-[(2-propan-2-yl-4-quinazolinyl)thio]ethyl]phenyl]acetamide IUPAC Name: N-[4-[2-(2-propan-2-ylquinazolin-4-yl)sulfanylacetyl]phenyl]acetamide Traditional Name: N-[4-[2-[(2-isopropylquinazolin-4-yl)thio]acetyl]phenyl]acetamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=CC=CC=C2C(=N1)SCC(=O)C3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CC(C)C1=NC2=CC=CC=C2C(=N1)SCC(=O)C3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C21H21N3O2S/c1-13(2)20-23-18-7-5-4-6-17(18)21(24-20)27-12-19(26)15-8-10-16(11-9-15)22-14(3)25/h4-11,13H,12H2,1-3H3,(H,22,25)