phenyl (1Z)-4-[[(3-azanylpyrazin-2-yl)carbonylamino]methyl]-N-methylsulfonyl-4-phenyl-piperidine-1-carboximidate

Systemtic Name: phenyl (1Z)-4-[[(3-azanylpyrazin-2-yl)carbonylamino]methyl]-N-methylsulfonyl-4-phenyl-piperidine-1-carboximidate Openeye Name: phenyl (1Z)-4-[[(3-aminopyrazine-2-carbonyl)amino]methyl]-N-methylsulfonyl-4-phenyl-piperidine-1-carboximidate CAS Name: (1Z)-4-[[[(3-amino-2-pyrazinyl)-oxomethyl]amino]methyl]-N-methylsulfonyl-4-phenyl-1-piperidinecarboximidic acid phenyl ester IUPAC Name: phenyl (1Z)-4-[[(3-aminopyrazine-2-carbonyl)amino]methyl]-N-methylsulfonyl-4-phenylpiperidine-1-carboximidate Traditional Name: (1Z)-4-[[(3-aminopyrazinoyl)amino]methyl]-N-mesyl-4-phenyl-piperidine-1-carboximidic acid phenyl ester Formula: C25H28N6O4S MolecularWeight: 508.59262

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N=C(N1CCC(CC1)(CNC(=O)C2=NC=CN=C2N)C3=CC=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)/N=C(/N1CCC(CC1)(CNC(=O)C2=NC=CN=C2N)C3=CC=CC=C3)\OC4=CC=CC=C4

InChI

InChI=1S/C25H28N6O4S/c1-36(33,34)30-24(35-20-10-6-3-7-11-20)31-16-12-25(13-17-31,19-8-4-2-5-9-19)18-29-23(32)21-22(26)28-15-14-27-21/h2-11,14-15H,12-13,16-18H2,1H3,(H2,26,28)(H,29,32)/b30-24-