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

Systemtic Name: N-[4-[2-(2-thiophen-2-ylquinazolin-4-yl)sulfanylethanoyl]phenyl]ethanamide Openeye Name: N-[4-[2-[2-(2-thienyl)quinazolin-4-yl]sulfanylacetyl]phenyl]acetamide CAS Name: N-[4-[1-oxo-2-[(2-thiophen-2-yl-4-quinazolinyl)thio]ethyl]phenyl]acetamide IUPAC Name: N-[4-[2-(2-thiophen-2-ylquinazolin-4-yl)sulfanylacetyl]phenyl]acetamide Traditional Name: N-[4-[2-[[2-(2-thienyl)quinazolin-4-yl]thio]acetyl]phenyl]acetamide Formula: C22H17N3O2S2 MolecularWeight: 419.51928

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NC(=NC3=CC=CC=C32)C4=CC=CS4

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NC(=NC3=CC=CC=C32)C4=CC=CS4

InChI

InChI=1S/C22H17N3O2S2/c1-14(26)23-16-10-8-15(9-11-16)19(27)13-29-22-17-5-2-3-6-18(17)24-21(25-22)20-7-4-12-28-20/h2-12H,13H2,1H3,(H,23,26)