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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N)N2CCC(CC2)C(=O)NCCNC(=O)CNS(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC1=CC(=NC(=N1)N)N2CCC(CC2)C(=O)NCCNC(=O)CNS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H31N7O4S/c1-17-14-22(31-25(26)30-17)32-12-8-19(9-13-32)24(34)28-11-10-27-23(33)16-29-37(35,36)21-7-6-18-4-2-3-5-20(18)15-21/h2-7,14-15,19,29H,8-13,16H2,1H3,(H,27,33)(H,28,34)(H2,26,30,31)