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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N3CCC(CC3)C(=O)N

Isomeric SMILES

CC(C)CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N3CCC(CC3)C(=O)N

InChI

InChI=1S/C20H26N4O3S/c1-13(2)11-24-19(27)15-5-3-4-6-16(15)22-20(24)28-12-17(25)23-9-7-14(8-10-23)18(21)26/h3-6,13-14H,7-12H2,1-2H3,(H2,21,26)