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

Systemtic Name: 1-[4-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)phenyl]carbonyl-4-piperidin-1-yl-piperidine-4-carboxamide Openeye Name: 1-[4-(4-oxo-2-thioxo-1H-quinazolin-3-yl)benzoyl]-4-(1-piperidyl)piperidine-4-carboxamide CAS Name: 1-[oxo-[4-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)phenyl]methyl]-4-(1-piperidinyl)-4-piperidinecarboxamide IUPAC Name: 1-[4-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)benzoyl]-4-piperidin-1-ylpiperidine-4-carboxamide Traditional Name: 1-[4-(4-keto-2-thioxo-1H-quinazolin-3-yl)benzoyl]-4-piperidino-isonipecotamide Formula: C26H29N5O3S MolecularWeight: 491.60516

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2(CCN(CC2)C(=O)C3=CC=C(C=C3)N4C(=O)C5=CC=CC=C5NC4=S)C(=O)N

Isomeric SMILES

C1CCN(CC1)C2(CCN(CC2)C(=O)C3=CC=C(C=C3)N4C(=O)C5=CC=CC=C5NC4=S)C(=O)N

InChI

InChI=1S/C26H29N5O3S/c27-24(34)26(30-14-4-1-5-15-30)12-16-29(17-13-26)22(32)18-8-10-19(11-9-18)31-23(33)20-6-2-3-7-21(20)28-25(31)35/h2-3,6-11H,1,4-5,12-17H2,(H2,27,34)(H,28,35)