N-[(2,3-dimethoxyphenyl)methyl]-1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)piperidine-4-carboxamide

Systemtic Name: N-[(2,3-dimethoxyphenyl)methyl]-1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)piperidine-4-carboxamide Openeye Name: N-[(2,3-dimethoxyphenyl)methyl]-1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)piperidine-4-carboxamide CAS Name: N-[(2,3-dimethoxyphenyl)methyl]-1-(4-methyl-7-methylsulfonyl-2-quinazolinyl)-4-piperidinecarboxamide IUPAC Name: N-[(2,3-dimethoxyphenyl)methyl]-1-(4-methyl-7-methylsulfonylquinazolin-2-yl)piperidine-4-carboxamide Traditional Name: 1-(7-mesyl-4-methyl-quinazolin-2-yl)-N-o-veratryl-isonipecotamide Formula: C25H30N4O5S MolecularWeight: 498.5945

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=C1C=CC(=C2)S(=O)(=O)C)N3CCC(CC3)C(=O)NCC4=C(C(=CC=C4)OC)OC

Isomeric SMILES

CC1=NC(=NC2=C1C=CC(=C2)S(=O)(=O)C)N3CCC(CC3)C(=O)NCC4=C(C(=CC=C4)OC)OC

InChI

InChI=1S/C25H30N4O5S/c1-16-20-9-8-19(35(4,31)32)14-21(20)28-25(27-16)29-12-10-17(11-13-29)24(30)26-15-18-6-5-7-22(33-2)23(18)34-3/h5-9,14,17H,10-13,15H2,1-4H3,(H,26,30)