1-[2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoyl]piperidine-4-carboxamide Openeye Name: 1-[2-(3-butyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]piperidine-4-carboxamide CAS Name: 1-[2-[(3-butyl-4-oxo-2-quinazolinyl)thio]-1-oxoethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-(3-butyl-4-oxoquinazolin-2-yl)sulfanylacetyl]piperidine-4-carboxamide Traditional Name: 1-[2-[(3-butyl-4-keto-quinazolin-2-yl)thio]acetyl]isonipecotamide Formula: C20H26N4O3S MolecularWeight: 402.51044

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N3CCC(CC3)C(=O)N

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N3CCC(CC3)C(=O)N

InChI

InChI=1S/C20H26N4O3S/c1-2-3-10-24-19(27)15-6-4-5-7-16(15)22-20(24)28-13-17(25)23-11-8-14(9-12-23)18(21)26/h4-7,14H,2-3,8-13H2,1H3,(H2,21,26)