2-(2-cyclopropylquinazolin-4-yl)sulfanyl-N-[(4-methoxyphenyl)methyl]-N-phenyl-ethanamide

Systemtic Name: 2-(2-cyclopropylquinazolin-4-yl)sulfanyl-N-[(4-methoxyphenyl)methyl]-N-phenyl-ethanamide Openeye Name: 2-(2-cyclopropylquinazolin-4-yl)sulfanyl-N-[(4-methoxyphenyl)methyl]-N-phenyl-acetamide CAS Name: 2-[(2-cyclopropyl-4-quinazolinyl)thio]-N-[(4-methoxyphenyl)methyl]-N-phenylacetamide IUPAC Name: 2-(2-cyclopropylquinazolin-4-yl)sulfanyl-N-[(4-methoxyphenyl)methyl]-N-phenylacetamide Traditional Name: 2-[(2-cyclopropylquinazolin-4-yl)thio]-N-p-anisyl-N-phenyl-acetamide Formula: C27H25N3O2S MolecularWeight: 455.5713

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN(C2=CC=CC=C2)C(=O)CSC3=NC(=NC4=CC=CC=C43)C5CC5

Isomeric SMILES

COC1=CC=C(C=C1)CN(C2=CC=CC=C2)C(=O)CSC3=NC(=NC4=CC=CC=C43)C5CC5

InChI

InChI=1S/C27H25N3O2S/c1-32-22-15-11-19(12-16-22)17-30(21-7-3-2-4-8-21)25(31)18-33-27-23-9-5-6-10-24(23)28-26(29-27)20-13-14-20/h2-12,15-16,20H,13-14,17-18H2,1H3