3-cyano-2-(2-ethoxyphenyl)-1-[(4-methyl-3-oxidanylidene-quinoxalin-2-yl)methyl]-1-(1-phenylethyl)guanidine

Systemtic Name: 3-cyano-2-(2-ethoxyphenyl)-1-[(4-methyl-3-oxidanylidene-quinoxalin-2-yl)methyl]-1-(1-phenylethyl)guanidine Openeye Name: 3-cyano-2-(2-ethoxyphenyl)-1-[(4-methyl-3-oxo-quinoxalin-2-yl)methyl]-1-(1-phenylethyl)guanidine CAS Name: 3-cyano-2-(2-ethoxyphenyl)-1-[(4-methyl-3-oxo-2-quinoxalinyl)methyl]-1-(1-phenylethyl)guanidine IUPAC Name: 3-cyano-2-(2-ethoxyphenyl)-1-[(4-methyl-3-oxoquinoxalin-2-yl)methyl]-1-(1-phenylethyl)guanidine Traditional Name: 3-cyano-1-[(3-keto-4-methyl-quinoxalin-2-yl)methyl]-2-o-phenetyl-1-(1-phenylethyl)guanidine Formula: C28H28N6O2 MolecularWeight: 480.56092

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N=C(NC#N)N(CC2=NC3=CC=CC=C3N(C2=O)C)C(C)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=CC=C1N=C(NC#N)N(CC2=NC3=CC=CC=C3N(C2=O)C)C(C)C4=CC=CC=C4

InChI

InChI=1S/C28H28N6O2/c1-4-36-26-17-11-9-15-23(26)32-28(30-19-29)34(20(2)21-12-6-5-7-13-21)18-24-27(35)33(3)25-16-10-8-14-22(25)31-24/h5-17,20H,4,18H2,1-3H3,(H,30,32)