1-[4-[(3,5-dimethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylmethyl]phenyl]carbonyl-N-methyl-N-(2-pyridin-2-ylethyl)piperidine-4-carboxamide

Systemtic Name: 1-[4-[(3,5-dimethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylmethyl]phenyl]carbonyl-N-methyl-N-(2-pyridin-2-ylethyl)piperidine-4-carboxamide Openeye Name: 1-[4-[(3,5-dimethyl-4-oxo-quinazolin-2-yl)sulfanylmethyl]benzoyl]-N-methyl-N-[2-(2-pyridyl)ethyl]piperidine-4-carboxamide CAS Name: 1-[[4-[[(3,5-dimethyl-4-oxo-2-quinazolinyl)thio]methyl]phenyl]-oxomethyl]-N-methyl-N-[2-(2-pyridinyl)ethyl]-4-piperidinecarboxamide IUPAC Name: 1-[4-[(3,5-dimethyl-4-oxoquinazolin-2-yl)sulfanylmethyl]benzoyl]-N-methyl-N-(2-pyridin-2-ylethyl)piperidine-4-carboxamide Traditional Name: 1-[4-[[(4-keto-3,5-dimethyl-quinazolin-2-yl)thio]methyl]benzoyl]-N-methyl-N-[2-(2-pyridyl)ethyl]isonipecotamide Formula: C32H35N5O3S MolecularWeight: 569.717

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N=C(N(C2=O)C)SCC3=CC=C(C=C3)C(=O)N4CCC(CC4)C(=O)N(C)CCC5=CC=CC=N5

Isomeric SMILES

CC1=C2C(=CC=C1)N=C(N(C2=O)C)SCC3=CC=C(C=C3)C(=O)N4CCC(CC4)C(=O)N(C)CCC5=CC=CC=N5

InChI

InChI=1S/C32H35N5O3S/c1-22-7-6-9-27-28(22)31(40)36(3)32(34-27)41-21-23-10-12-24(13-11-23)30(39)37-19-14-25(15-20-37)29(38)35(2)18-16-26-8-4-5-17-33-26/h4-13,17,25H,14-16,18-21H2,1-3H3