(2S)-N-(2-methoxyethyl)-1-(4-methylphenyl)sulfonyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]piperidine-2-carboxamide

Systemtic Name: (2S)-N-(2-methoxyethyl)-1-(4-methylphenyl)sulfonyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]piperidine-2-carboxamide Openeye Name: (2S)-N-(2-methoxyethyl)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-1-(p-tolylsulfonyl)piperidine-2-carboxamide CAS Name: (2S)-N-(2-methoxyethyl)-1-(4-methylphenyl)sulfonyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-2-piperidinecarboxamide IUPAC Name: (2S)-N-(2-methoxyethyl)-1-(4-methylphenyl)sulfonyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]piperidine-2-carboxamide Traditional Name: (2S)-N-[(4-keto-1H-quinazolin-2-yl)methyl]-N-(2-methoxyethyl)-1-tosyl-pipecolinamide Formula: C25H30N4O5S MolecularWeight: 498.5945

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2C(=O)N(CCOC)CC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC[C@H]2C(=O)N(CCOC)CC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C25H30N4O5S/c1-18-10-12-19(13-11-18)35(32,33)29-14-6-5-9-22(29)25(31)28(15-16-34-2)17-23-26-21-8-4-3-7-20(21)24(30)27-23/h3-4,7-8,10-13,22H,5-6,9,14-17H2,1-2H3,(H,26,27,30)/t22-/m0/s1