2-[(1-naphthalen-2-ylsulfonylazepan-4-yl)amino]-N-(oxan-2-yloxy)pyrimidine-5-carboxamide

Systemtic Name: 2-[(1-naphthalen-2-ylsulfonylazepan-4-yl)amino]-N-(oxan-2-yloxy)pyrimidine-5-carboxamide Openeye Name: 2-[[1-(2-naphthylsulfonyl)azepan-4-yl]amino]-N-tetrahydropyran-2-yloxy-pyrimidine-5-carboxamide CAS Name: 2-[[1-(2-naphthalenylsulfonyl)-4-azepanyl]amino]-N-(2-oxanyloxy)-5-pyrimidinecarboxamide IUPAC Name: 2-[(1-naphthalen-2-ylsulfonylazepan-4-yl)amino]-N-(oxan-2-yloxy)pyrimidine-5-carboxamide Traditional Name: 2-[[1-(2-naphthylsulfonyl)azepan-4-yl]amino]-N-tetrahydropyran-2-yloxy-pyrimidine-5-carboxamide Formula: C26H31N5O5S MolecularWeight: 525.61984

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)ONC(=O)C2=CN=C(N=C2)NC3CCCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CCOC(C1)ONC(=O)C2=CN=C(N=C2)NC3CCCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C26H31N5O5S/c32-25(30-36-24-9-3-4-15-35-24)21-17-27-26(28-18-21)29-22-8-5-13-31(14-12-22)37(33,34)23-11-10-19-6-1-2-7-20(19)16-23/h1-2,6-7,10-11,16-18,22,24H,3-5,8-9,12-15H2,(H,30,32)(H,27,28,29)