N-(4-morpholin-4-ylphenyl)-2-(2-propan-2-ylquinazolin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-morpholin-4-ylphenyl)-2-(2-propan-2-ylquinazolin-4-yl)sulfanyl-ethanamide Openeye Name: 2-(2-isopropylquinazolin-4-yl)sulfanyl-N-(4-morpholinophenyl)acetamide CAS Name: N-[4-(4-morpholinyl)phenyl]-2-[(2-propan-2-yl-4-quinazolinyl)thio]acetamide IUPAC Name: N-(4-morpholin-4-ylphenyl)-2-(2-propan-2-ylquinazolin-4-yl)sulfanylacetamide Traditional Name: 2-[(2-isopropylquinazolin-4-yl)thio]-N-(4-morpholinophenyl)acetamide Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=CC=CC=C2C(=N1)SCC(=O)NC3=CC=C(C=C3)N4CCOCC4

Isomeric SMILES

CC(C)C1=NC2=CC=CC=C2C(=N1)SCC(=O)NC3=CC=C(C=C3)N4CCOCC4

InChI

InChI=1S/C23H26N4O2S/c1-16(2)22-25-20-6-4-3-5-19(20)23(26-22)30-15-21(28)24-17-7-9-18(10-8-17)27-11-13-29-14-12-27/h3-10,16H,11-15H2,1-2H3,(H,24,28)