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

Systemtic Name: (3R)-1-[2-(7-chloranyl-4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanylethanoyl]piperidine-3-carboxamide Openeye Name: (3R)-1-[2-(7-chloro-4-oxo-3-propyl-quinazolin-2-yl)sulfanylacetyl]piperidine-3-carboxamide CAS Name: (3R)-1-[2-[(7-chloro-4-oxo-3-propyl-2-quinazolinyl)thio]-1-oxoethyl]-3-piperidinecarboxamide IUPAC Name: (3R)-1-[2-(7-chloro-4-oxo-3-propylquinazolin-2-yl)sulfanylacetyl]piperidine-3-carboxamide Traditional Name: (3R)-1-[2-[(7-chloro-4-keto-3-propyl-quinazolin-2-yl)thio]acetyl]nipecotamide Formula: C19H23ClN4O3S MolecularWeight: 422.92892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)N3CCCC(C3)C(=O)N

Isomeric SMILES

CCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)N3CCC[C@H](C3)C(=O)N

InChI

InChI=1S/C19H23ClN4O3S/c1-2-7-24-18(27)14-6-5-13(20)9-15(14)22-19(24)28-11-16(25)23-8-3-4-12(10-23)17(21)26/h5-6,9,12H,2-4,7-8,10-11H2,1H3,(H2,21,26)/t12-/m1/s1