methyl 3-[[[1-(4-methoxyphenyl)cyclopentyl]carbonylamino]methyl]-5-(pyrazin-2-ylcarbonylamino)benzoate

Systemtic Name: methyl 3-[[[1-(4-methoxyphenyl)cyclopentyl]carbonylamino]methyl]-5-(pyrazin-2-ylcarbonylamino)benzoate Openeye Name: methyl 3-[[[1-(4-methoxyphenyl)cyclopentanecarbonyl]amino]methyl]-5-(pyrazine-2-carbonylamino)benzoate CAS Name: 3-[[[[1-(4-methoxyphenyl)cyclopentyl]-oxomethyl]amino]methyl]-5-[[oxo(2-pyrazinyl)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[[1-(4-methoxyphenyl)cyclopentanecarbonyl]amino]methyl]-5-(pyrazine-2-carbonylamino)benzoate Traditional Name: 3-[[[1-(4-methoxyphenyl)cyclopentanecarbonyl]amino]methyl]-5-(pyrazinoylamino)benzoic acid methyl ester Formula: C27H28N4O5 MolecularWeight: 488.53502

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2(CCCC2)C(=O)NCC3=CC(=CC(=C3)C(=O)OC)NC(=O)C4=NC=CN=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2(CCCC2)C(=O)NCC3=CC(=CC(=C3)C(=O)OC)NC(=O)C4=NC=CN=C4

InChI

InChI=1S/C27H28N4O5/c1-35-22-7-5-20(6-8-22)27(9-3-4-10-27)26(34)30-16-18-13-19(25(33)36-2)15-21(14-18)31-24(32)23-17-28-11-12-29-23/h5-8,11-15,17H,3-4,9-10,16H2,1-2H3,(H,30,34)(H,31,32)