ethyl 3-[[4-[(5-azanyl-6-cyano-pyrazin-2-yl)methyl-methyl-amino]phenyl]carbonylamino]butanoate

Systemtic Name: ethyl 3-[[4-[(5-azanyl-6-cyano-pyrazin-2-yl)methyl-methyl-amino]phenyl]carbonylamino]butanoate Openeye Name: ethyl 3-[[4-[(5-amino-6-cyano-pyrazin-2-yl)methyl-methyl-amino]benzoyl]amino]butanoate CAS Name: 3-[[[4-[(5-amino-6-cyano-2-pyrazinyl)methyl-methylamino]phenyl]-oxomethyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 3-[[4-[(5-amino-6-cyanopyrazin-2-yl)methyl-methylamino]benzoyl]amino]butanoate Traditional Name: 3-[[4-[(5-amino-6-cyano-pyrazin-2-yl)methyl-methyl-amino]benzoyl]amino]butyric acid ethyl ester Formula: C20H24N6O3 MolecularWeight: 396.44296

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N6O3/c1-4-29-18(27)9-13(2)24-20(28)14-5-7-16(8-6-14)26(3)12-15-11-23-19(22)17(10-21)25-15/h5-8,11,13H,4,9,12H2,1-3H3,(H2,22,23)(H,24,28)