N-(1,3-benzothiazol-2-ylmethyl)-2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(4-oxo-3-phenyl-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(4-oxo-3-phenyl-2-quinazolinyl)thio]acetamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(4-oxo-3-phenylquinazolin-2-yl)sulfanylacetamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(4-keto-3-phenyl-quinazolin-2-yl)thio]acetamide Formula: C24H18N4O2S2 MolecularWeight: 458.55532

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C24H18N4O2S2/c29-21(25-14-22-26-19-12-6-7-13-20(19)32-22)15-31-24-27-18-11-5-4-10-17(18)23(30)28(24)16-8-2-1-3-9-16/h1-13H,14-15H2,(H,25,29)