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

Systemtic Name: N-[(4-methoxyphenyl)methyl]-2-(2-propylquinazolin-4-yl)sulfanyl-ethanamide Openeye Name: N-[(4-methoxyphenyl)methyl]-2-(2-propylquinazolin-4-yl)sulfanyl-acetamide CAS Name: N-[(4-methoxyphenyl)methyl]-2-[(2-propyl-4-quinazolinyl)thio]acetamide IUPAC Name: N-[(4-methoxyphenyl)methyl]-2-(2-propylquinazolin-4-yl)sulfanylacetamide Traditional Name: N-p-anisyl-2-[(2-propylquinazolin-4-yl)thio]acetamide Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=CC=CC=C2C(=N1)SCC(=O)NCC3=CC=C(C=C3)OC

Isomeric SMILES

CCCC1=NC2=CC=CC=C2C(=N1)SCC(=O)NCC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H23N3O2S/c1-3-6-19-23-18-8-5-4-7-17(18)21(24-19)27-14-20(25)22-13-15-9-11-16(26-2)12-10-15/h4-5,7-12H,3,6,13-14H2,1-2H3,(H,22,25)