N-(3-ethoxypropyl)-1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)piperidine-4-carboxamide

Systemtic Name: N-(3-ethoxypropyl)-1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)piperidine-4-carboxamide Openeye Name: N-(3-ethoxypropyl)-1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)piperidine-4-carboxamide CAS Name: N-(3-ethoxypropyl)-1-(4-methyl-7-methylsulfonyl-2-quinazolinyl)-4-piperidinecarboxamide IUPAC Name: N-(3-ethoxypropyl)-1-(4-methyl-7-methylsulfonylquinazolin-2-yl)piperidine-4-carboxamide Traditional Name: N-(3-ethoxypropyl)-1-(7-mesyl-4-methyl-quinazolin-2-yl)isonipecotamide Formula: C21H30N4O4S MolecularWeight: 434.5523

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)C1CCN(CC1)C2=NC3=C(C=CC(=C3)S(=O)(=O)C)C(=N2)C

Isomeric SMILES

CCOCCCNC(=O)C1CCN(CC1)C2=NC3=C(C=CC(=C3)S(=O)(=O)C)C(=N2)C

InChI

InChI=1S/C21H30N4O4S/c1-4-29-13-5-10-22-20(26)16-8-11-25(12-9-16)21-23-15(2)18-7-6-17(30(3,27)28)14-19(18)24-21/h6-7,14,16H,4-5,8-13H2,1-3H3,(H,22,26)