1-(2-azanyl-6-methyl-pyrimidin-4-yl)-N-[1-azanyl-2-(naphthalen-2-ylsulfonylamino)-1-oxidanylidene-butan-2-yl]piperidine-4-carboxamide

Systemtic Name: 1-(2-azanyl-6-methyl-pyrimidin-4-yl)-N-[1-azanyl-2-(naphthalen-2-ylsulfonylamino)-1-oxidanylidene-butan-2-yl]piperidine-4-carboxamide Openeye Name: 1-(2-amino-6-methyl-pyrimidin-4-yl)-N-[1-carbamoyl-1-(2-naphthylsulfonylamino)propyl]piperidine-4-carboxamide CAS Name: 1-(2-amino-6-methyl-4-pyrimidinyl)-N-[1-amino-2-(2-naphthalenylsulfonylamino)-1-oxobutan-2-yl]-4-piperidinecarboxamide IUPAC Name: 1-(2-amino-6-methylpyrimidin-4-yl)-N-[1-amino-2-(naphthalen-2-ylsulfonylamino)-1-oxobutan-2-yl]piperidine-4-carboxamide Traditional Name: 1-(2-amino-6-methyl-pyrimidin-4-yl)-N-[1-carbamoyl-1-(2-naphthylsulfonylamino)propyl]isonipecotamide Formula: C25H31N7O4S MolecularWeight: 525.62314

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N)(NC(=O)C1CCN(CC1)C2=NC(=NC(=C2)C)N)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCC(C(=O)N)(NC(=O)C1CCN(CC1)C2=NC(=NC(=C2)C)N)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H31N7O4S/c1-3-25(23(26)34,31-37(35,36)20-9-8-17-6-4-5-7-19(17)15-20)30-22(33)18-10-12-32(13-11-18)21-14-16(2)28-24(27)29-21/h4-9,14-15,18,31H,3,10-13H2,1-2H3,(H2,26,34)(H,30,33)(H2,27,28,29)