N-(4-chlorophenyl)-N-[2-(cyclohexylamino)-2-oxidanylidene-1-phenyl-ethyl]pyrazine-2-carboxamide

Systemtic Name: N-(4-chlorophenyl)-N-[2-(cyclohexylamino)-2-oxidanylidene-1-phenyl-ethyl]pyrazine-2-carboxamide Openeye Name: N-(4-chlorophenyl)-N-[2-(cyclohexylamino)-2-oxo-1-phenyl-ethyl]pyrazine-2-carboxamide CAS Name: N-(4-chlorophenyl)-N-[2-(cyclohexylamino)-2-oxo-1-phenylethyl]-2-pyrazinecarboxamide IUPAC Name: N-(4-chlorophenyl)-N-[2-(cyclohexylamino)-2-oxo-1-phenylethyl]pyrazine-2-carboxamide Traditional Name: N-(4-chlorophenyl)-N-[2-(cyclohexylamino)-2-keto-1-phenyl-ethyl]pyrazinamide Formula: C25H25ClN4O2 MolecularWeight: 448.9446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C(C2=CC=CC=C2)N(C3=CC=C(C=C3)Cl)C(=O)C4=NC=CN=C4

Isomeric SMILES

C1CCC(CC1)NC(=O)C(C2=CC=CC=C2)N(C3=CC=C(C=C3)Cl)C(=O)C4=NC=CN=C4

InChI

InChI=1S/C25H25ClN4O2/c26-19-11-13-21(14-12-19)30(25(32)22-17-27-15-16-28-22)23(18-7-3-1-4-8-18)24(31)29-20-9-5-2-6-10-20/h1,3-4,7-8,11-17,20,23H,2,5-6,9-10H2,(H,29,31)