N,N-diethyl-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-2-phenyl-ethanamide

Systemtic Name: N,N-diethyl-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-2-phenyl-ethanamide Openeye Name: 2-(3-allyl-4-oxo-quinazolin-2-yl)sulfanyl-N,N-diethyl-2-phenyl-acetamide CAS Name: N,N-diethyl-2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]-2-phenylacetamide IUPAC Name: N,N-diethyl-2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanyl-2-phenylacetamide Traditional Name: 2-[(3-allyl-4-keto-quinazolin-2-yl)thio]-N,N-diethyl-2-phenyl-acetamide Formula: C23H25N3O2S MolecularWeight: 407.5285

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C(C1=CC=CC=C1)SC2=NC3=CC=CC=C3C(=O)N2CC=C

Isomeric SMILES

CCN(CC)C(=O)C(C1=CC=CC=C1)SC2=NC3=CC=CC=C3C(=O)N2CC=C

InChI

InChI=1S/C23H25N3O2S/c1-4-16-26-21(27)18-14-10-11-15-19(18)24-23(26)29-20(17-12-8-7-9-13-17)22(28)25(5-2)6-3/h4,7-15,20H,1,5-6,16H2,2-3H3