N-[4-[2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylethanoyl]phenyl]butanamide

Systemtic Name: N-[4-[2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylethanoyl]phenyl]butanamide Openeye Name: N-[4-[2-(3-allyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]phenyl]butanamide CAS Name: N-[4-[1-oxo-2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]ethyl]phenyl]butanamide IUPAC Name: N-[4-[2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylacetyl]phenyl]butanamide Traditional Name: N-[4-[2-[(3-allyl-4-keto-quinazolin-2-yl)thio]acetyl]phenyl]butyramide Formula: C23H23N3O3S MolecularWeight: 421.51202

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC=C

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC=C

InChI

InChI=1S/C23H23N3O3S/c1-3-7-21(28)24-17-12-10-16(11-13-17)20(27)15-30-23-25-19-9-6-5-8-18(19)22(29)26(23)14-4-2/h4-6,8-13H,2-3,7,14-15H2,1H3,(H,24,28)