N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-1-ethyl-3-methyl-2-oxidanylidene-quinoxaline-6-carboxamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-1-ethyl-3-methyl-2-oxidanylidene-quinoxaline-6-carboxamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-1-ethyl-3-methyl-2-oxo-quinoxaline-6-carboxamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]ethyl]-1-ethyl-3-methyl-2-oxo-6-quinoxalinecarboxamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-1-ethyl-3-methyl-2-oxoquinoxaline-6-carboxamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]ethyl]-1-ethyl-2-keto-3-methyl-quinoxaline-6-carboxamide Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)NCCSCC3=CC=CC=C3C#N)N=C(C1=O)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)NCCSCC3=CC=CC=C3C#N)N=C(C1=O)C

InChI

InChI=1S/C22H22N4O2S/c1-3-26-20-9-8-16(12-19(20)25-15(2)22(26)28)21(27)24-10-11-29-14-18-7-5-4-6-17(18)13-23/h4-9,12H,3,10-11,14H2,1-2H3,(H,24,27)