N-[2-(cyclohexylamino)-1-(4-ethylphenyl)-2-oxidanylidene-ethyl]-N-thiophen-2-yl-pyrazine-2-carboxamide

Systemtic Name: N-[2-(cyclohexylamino)-1-(4-ethylphenyl)-2-oxidanylidene-ethyl]-N-thiophen-2-yl-pyrazine-2-carboxamide Openeye Name: N-[2-(cyclohexylamino)-1-(4-ethylphenyl)-2-oxo-ethyl]-N-(2-thienyl)pyrazine-2-carboxamide CAS Name: N-[2-(cyclohexylamino)-1-(4-ethylphenyl)-2-oxoethyl]-N-thiophen-2-yl-2-pyrazinecarboxamide IUPAC Name: N-[2-(cyclohexylamino)-1-(4-ethylphenyl)-2-oxoethyl]-N-thiophen-2-ylpyrazine-2-carboxamide Traditional Name: N-[2-(cyclohexylamino)-1-(4-ethylphenyl)-2-keto-ethyl]-N-(2-thienyl)pyrazinamide Formula: C25H28N4O2S MolecularWeight: 448.58042

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C(=O)NC2CCCCC2)N(C3=CC=CS3)C(=O)C4=NC=CN=C4

Isomeric SMILES

CCC1=CC=C(C=C1)C(C(=O)NC2CCCCC2)N(C3=CC=CS3)C(=O)C4=NC=CN=C4

InChI

InChI=1S/C25H28N4O2S/c1-2-18-10-12-19(13-11-18)23(24(30)28-20-7-4-3-5-8-20)29(22-9-6-16-32-22)25(31)21-17-26-14-15-27-21/h6,9-17,20,23H,2-5,7-8H2,1H3,(H,28,30)