N-[(1S)-2-(cyclohexylamino)-2-oxidanylidene-1-phenyl-ethyl]-N-[(3-methoxyphenyl)methyl]pyrazine-2-carboxamide

Systemtic Name: N-[(1S)-2-(cyclohexylamino)-2-oxidanylidene-1-phenyl-ethyl]-N-[(3-methoxyphenyl)methyl]pyrazine-2-carboxamide Openeye Name: N-[(1S)-2-(cyclohexylamino)-2-oxo-1-phenyl-ethyl]-N-[(3-methoxyphenyl)methyl]pyrazine-2-carboxamide CAS Name: N-[(1S)-2-(cyclohexylamino)-2-oxo-1-phenylethyl]-N-[(3-methoxyphenyl)methyl]-2-pyrazinecarboxamide IUPAC Name: N-[(1S)-2-(cyclohexylamino)-2-oxo-1-phenylethyl]-N-[(3-methoxyphenyl)methyl]pyrazine-2-carboxamide Traditional Name: N-[(1S)-2-(cyclohexylamino)-2-keto-1-phenyl-ethyl]-N-m-anisyl-pyrazinamide Formula: C27H30N4O3 MolecularWeight: 458.5521

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN(C(C2=CC=CC=C2)C(=O)NC3CCCCC3)C(=O)C4=NC=CN=C4

Isomeric SMILES

COC1=CC=CC(=C1)CN([C@@H](C2=CC=CC=C2)C(=O)NC3CCCCC3)C(=O)C4=NC=CN=C4

InChI

InChI=1S/C27H30N4O3/c1-34-23-14-8-9-20(17-23)19-31(27(33)24-18-28-15-16-29-24)25(21-10-4-2-5-11-21)26(32)30-22-12-6-3-7-13-22/h2,4-5,8-11,14-18,22,25H,3,6-7,12-13,19H2,1H3,(H,30,32)/t25-/m0/s1