1-[2-(4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanylethanoyl]-N-phenyl-piperidine-3-carboxamide

Systemtic Name: 1-[2-(4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanylethanoyl]-N-phenyl-piperidine-3-carboxamide Openeye Name: 1-[2-(3-isopropyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]-N-phenyl-piperidine-3-carboxamide CAS Name: 1-[1-oxo-2-[(4-oxo-3-propan-2-yl-2-quinazolinyl)thio]ethyl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: 1-[2-(4-oxo-3-propan-2-ylquinazolin-2-yl)sulfanylacetyl]-N-phenylpiperidine-3-carboxamide Traditional Name: 1-[2-[(3-isopropyl-4-keto-quinazolin-2-yl)thio]acetyl]-N-phenyl-nipecotamide Formula: C25H28N4O3S MolecularWeight: 464.57982

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)N3CCCC(C3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)N3CCCC(C3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C25H28N4O3S/c1-17(2)29-24(32)20-12-6-7-13-21(20)27-25(29)33-16-22(30)28-14-8-9-18(15-28)23(31)26-19-10-4-3-5-11-19/h3-7,10-13,17-18H,8-9,14-16H2,1-2H3,(H,26,31)