diethyl 2-[[4-[(5-azanylidene-6-cyano-4-oxidanyl-pyrazin-2-yl)methyl-methyl-amino]phenyl]carbonylamino]hexanedioate

Systemtic Name: diethyl 2-[[4-[(5-azanylidene-6-cyano-4-oxidanyl-pyrazin-2-yl)methyl-methyl-amino]phenyl]carbonylamino]hexanedioate Openeye Name: diethyl 2-[[4-[(6-cyano-4-hydroxy-5-imino-pyrazin-2-yl)methyl-methyl-amino]benzoyl]amino]hexanedioate CAS Name: 2-[[[4-[(6-cyano-4-hydroxy-5-imino-2-pyrazinyl)methyl-methylamino]phenyl]-oxomethyl]amino]hexanedioic acid diethyl ester IUPAC Name: diethyl 2-[[4-[(6-cyano-4-hydroxy-5-iminopyrazin-2-yl)methyl-methylamino]benzoyl]amino]hexanedioate Traditional Name: 2-[[4-[(6-cyano-4-hydroxy-5-imino-pyrazin-2-yl)methyl-methyl-amino]benzoyl]amino]adipic acid diethyl ester Formula: C24H30N6O6 MolecularWeight: 498.5316

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCC(C(=O)OCC)NC(=O)C1=CC=C(C=C1)N(C)CC2=CN(C(=N)C(=N2)C#N)O

Isomeric SMILES

CCOC(=O)CCCC(C(=O)OCC)NC(=O)C1=CC=C(C=C1)N(C)CC2=CN(C(=N)C(=N2)C#N)O

InChI

InChI=1S/C24H30N6O6/c1-4-35-21(31)8-6-7-19(24(33)36-5-2)28-23(32)16-9-11-18(12-10-16)29(3)14-17-15-30(34)22(26)20(13-25)27-17/h9-12,15,19,26,34H,4-8,14H2,1-3H3,(H,28,32)