methyl 4-[[2-chloranyl-4-[(5-cyanopyrazin-2-yl)carbamoylamino]-5-methoxy-phenyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[[2-chloranyl-4-[(5-cyanopyrazin-2-yl)carbamoylamino]-5-methoxy-phenyl]amino]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[2-chloro-4-[(5-cyanopyrazin-2-yl)carbamoylamino]-5-methoxy-anilino]-4-oxo-butanoate CAS Name: 4-[2-chloro-4-[[[(5-cyano-2-pyrazinyl)amino]-oxomethyl]amino]-5-methoxyanilino]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[2-chloro-4-[(5-cyanopyrazin-2-yl)carbamoylamino]-5-methoxyanilino]-4-oxobutanoate Traditional Name: 4-[2-chloro-4-[(5-cyanopyrazin-2-yl)carbamoylamino]-5-methoxy-anilino]-4-keto-butyric acid methyl ester Formula: C18H17ClN6O5 MolecularWeight: 432.81778

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)NC(=O)CCC(=O)OC)Cl)NC(=O)NC2=NC=C(N=C2)C#N

Isomeric SMILES

COC1=C(C=C(C(=C1)NC(=O)CCC(=O)OC)Cl)NC(=O)NC2=NC=C(N=C2)C#N

InChI

InChI=1S/C18H17ClN6O5/c1-29-14-6-12(23-16(26)3-4-17(27)30-2)11(19)5-13(14)24-18(28)25-15-9-21-10(7-20)8-22-15/h5-6,8-9H,3-4H2,1-2H3,(H,23,26)(H2,22,24,25,28)