4-[(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylmethyl]-N-phenyl-benzamide

Systemtic Name: 4-[(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylmethyl]-N-phenyl-benzamide Openeye Name: 4-[(3-allyl-4-oxo-quinazolin-2-yl)sulfanylmethyl]-N-phenyl-benzamide CAS Name: 4-[[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]methyl]-N-phenylbenzamide IUPAC Name: 4-[(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylmethyl]-N-phenylbenzamide Traditional Name: 4-[[(3-allyl-4-keto-quinazolin-2-yl)thio]methyl]-N-phenyl-benzamide Formula: C25H21N3O2S MolecularWeight: 427.51814

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C=CCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C25H21N3O2S/c1-2-16-28-24(30)21-10-6-7-11-22(21)27-25(28)31-17-18-12-14-19(15-13-18)23(29)26-20-8-4-3-5-9-20/h2-15H,1,16-17H2,(H,26,29)