N-[(4-ethylphenyl)methyl]-N-methyl-1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)piperidine-4-carboxamide

Systemtic Name: N-[(4-ethylphenyl)methyl]-N-methyl-1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)piperidine-4-carboxamide Openeye Name: N-[(4-ethylphenyl)methyl]-N-methyl-1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)piperidine-4-carboxamide CAS Name: N-[(4-ethylphenyl)methyl]-N-methyl-1-(4-methyl-7-methylsulfonyl-2-quinazolinyl)-4-piperidinecarboxamide IUPAC Name: N-[(4-ethylphenyl)methyl]-N-methyl-1-(4-methyl-7-methylsulfonylquinazolin-2-yl)piperidine-4-carboxamide Traditional Name: N-(4-ethylbenzyl)-1-(7-mesyl-4-methyl-quinazolin-2-yl)-N-methyl-isonipecotamide Formula: C26H32N4O3S MolecularWeight: 480.62228

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN(C)C(=O)C2CCN(CC2)C3=NC4=C(C=CC(=C4)S(=O)(=O)C)C(=N3)C

Isomeric SMILES

CCC1=CC=C(C=C1)CN(C)C(=O)C2CCN(CC2)C3=NC4=C(C=CC(=C4)S(=O)(=O)C)C(=N3)C

InChI

InChI=1S/C26H32N4O3S/c1-5-19-6-8-20(9-7-19)17-29(3)25(31)21-12-14-30(15-13-21)26-27-18(2)23-11-10-22(34(4,32)33)16-24(23)28-26/h6-11,16,21H,5,12-15,17H2,1-4H3