N-[[1-[4-(cyclopropylamino)-5-nitro-pyrimidin-2-yl]piperidin-3-yl]methyl]methanesulfonamide

Systemtic Name: N-[[1-[4-(cyclopropylamino)-5-nitro-pyrimidin-2-yl]piperidin-3-yl]methyl]methanesulfonamide Openeye Name: N-[[1-[4-(cyclopropylamino)-5-nitro-pyrimidin-2-yl]-3-piperidyl]methyl]methanesulfonamide CAS Name: N-[[1-[4-(cyclopropylamino)-5-nitro-2-pyrimidinyl]-3-piperidinyl]methyl]methanesulfonamide IUPAC Name: N-[[1-[4-(cyclopropylamino)-5-nitropyrimidin-2-yl]piperidin-3-yl]methyl]methanesulfonamide Traditional Name: N-[[1-[4-(cyclopropylamino)-5-nitro-pyrimidin-2-yl]-3-piperidyl]methyl]methanesulfonamide Formula: C14H22N6O4S MolecularWeight: 370.42728

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCC1CCCN(C1)C2=NC=C(C(=N2)NC3CC3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)NCC1CCCN(C1)C2=NC=C(C(=N2)NC3CC3)[N+](=O)[O-]

InChI

InChI=1S/C14H22N6O4S/c1-25(23,24)16-7-10-3-2-6-19(9-10)14-15-8-12(20(21)22)13(18-14)17-11-4-5-11/h8,10-11,16H,2-7,9H2,1H3,(H,15,17,18)