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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=CC=CC=C2C(=N1)SCC(=O)NCC3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)C1=NC2=CC=CC=C2C(=N1)SCC(=O)NCC3=CC=C(C=C3)OC

InChI

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