N-methyl-6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-[(4-piperidin-1-ylphenyl)methyl]hexanamide

Systemtic Name: N-methyl-6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-[(4-piperidin-1-ylphenyl)methyl]hexanamide Openeye Name: N-methyl-6-(4-oxo-2-thioxo-1H-quinazolin-3-yl)-N-[[4-(1-piperidyl)phenyl]methyl]hexanamide CAS Name: N-methyl-6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-[[4-(1-piperidinyl)phenyl]methyl]hexanamide IUPAC Name: N-methyl-6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-[(4-piperidin-1-ylphenyl)methyl]hexanamide Traditional Name: 6-(4-keto-2-thioxo-1H-quinazolin-3-yl)-N-methyl-N-(4-piperidinobenzyl)hexanamide Formula: C27H34N4O2S MolecularWeight: 478.64946

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)N2CCCCC2)C(=O)CCCCCN3C(=O)C4=CC=CC=C4NC3=S

Isomeric SMILES

CN(CC1=CC=C(C=C1)N2CCCCC2)C(=O)CCCCCN3C(=O)C4=CC=CC=C4NC3=S

InChI

InChI=1S/C27H34N4O2S/c1-29(20-21-13-15-22(16-14-21)30-17-7-3-8-18-30)25(32)12-4-2-9-19-31-26(33)23-10-5-6-11-24(23)28-27(31)34/h5-6,10-11,13-16H,2-4,7-9,12,17-20H2,1H3,(H,28,34)