1-[4-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)phenyl]carbonylpiperidine-4-carboxamide

Systemtic Name: 1-[4-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)phenyl]carbonylpiperidine-4-carboxamide Openeye Name: 1-[4-(4-oxo-2-thioxo-1H-quinazolin-3-yl)benzoyl]piperidine-4-carboxamide CAS Name: 1-[oxo-[4-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)phenyl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-[4-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)benzoyl]piperidine-4-carboxamide Traditional Name: 1-[4-(4-keto-2-thioxo-1H-quinazolin-3-yl)benzoyl]isonipecotamide Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)C(=O)C2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4NC3=S

Isomeric SMILES

C1CN(CCC1C(=O)N)C(=O)C2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4NC3=S

InChI

InChI=1S/C21H20N4O3S/c22-18(26)13-9-11-24(12-10-13)19(27)14-5-7-15(8-6-14)25-20(28)16-3-1-2-4-17(16)23-21(25)29/h1-8,13H,9-12H2,(H2,22,26)(H,23,29)