N-[4-[(S)-cyano-(3-phenylazanylquinoxalin-2-yl)methyl]sulfonylphenyl]ethanamide

Systemtic Name: N-[4-[(S)-cyano-(3-phenylazanylquinoxalin-2-yl)methyl]sulfonylphenyl]ethanamide Openeye Name: N-[4-[(S)-(3-anilinoquinoxalin-2-yl)-cyano-methyl]sulfonylphenyl]acetamide CAS Name: N-[4-[(S)-(3-anilino-2-quinoxalinyl)-cyanomethyl]sulfonylphenyl]acetamide IUPAC Name: N-[4-[(S)-(3-anilinoquinoxalin-2-yl)-cyanomethyl]sulfonylphenyl]acetamide Traditional Name: N-[4-[(S)-(3-anilinoquinoxalin-2-yl)-cyano-methyl]sulfonylphenyl]acetamide Formula: C24H19N5O3S MolecularWeight: 457.50436

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)C(C#N)C2=NC3=CC=CC=C3N=C2NC4=CC=CC=C4

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)[C@H](C#N)C2=NC3=CC=CC=C3N=C2NC4=CC=CC=C4

InChI

InChI=1S/C24H19N5O3S/c1-16(30)26-18-11-13-19(14-12-18)33(31,32)22(15-25)23-24(27-17-7-3-2-4-8-17)29-21-10-6-5-9-20(21)28-23/h2-14,22H,1H3,(H,26,30)(H,27,29)/t22-/m1/s1