1-[2-(7-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylethanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-(7-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylethanoyl]piperidine-4-carboxamide Openeye Name: 1-[2-(3-allyl-7-chloro-4-oxo-quinazolin-2-yl)sulfanylacetyl]piperidine-4-carboxamide CAS Name: 1-[2-[(7-chloro-4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]-1-oxoethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-(7-chloro-4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylacetyl]piperidine-4-carboxamide Traditional Name: 1-[2-[(3-allyl-7-chloro-4-keto-quinazolin-2-yl)thio]acetyl]isonipecotamide Formula: C19H21ClN4O3S MolecularWeight: 420.91304

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)N3CCC(CC3)C(=O)N

Isomeric SMILES

C=CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)N3CCC(CC3)C(=O)N

InChI

InChI=1S/C19H21ClN4O3S/c1-2-7-24-18(27)14-4-3-13(20)10-15(14)22-19(24)28-11-16(25)23-8-5-12(6-9-23)17(21)26/h2-4,10,12H,1,5-9,11H2,(H2,21,26)