4-[2-[(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methylsulfanyl]ethanoyl]-3,3-dimethyl-1H-quinoxalin-2-one

Systemtic Name: 4-[2-[(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methylsulfanyl]ethanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Openeye Name: 4-[2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylsulfanyl]acetyl]-3,3-dimethyl-1H-quinoxalin-2-one CAS Name: 4-[2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylthio]-1-oxoethyl]-3,3-dimethyl-1H-quinoxalin-2-one IUPAC Name: 4-[2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylsulfanyl]acetyl]-3,3-dimethyl-1H-quinoxalin-2-one Traditional Name: 4-[2-[(4-amino-6-anilino-s-triazin-2-yl)methylthio]acetyl]-3,3-dimethyl-1H-quinoxalin-2-one Formula: C22H23N7O2S MolecularWeight: 449.52872

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)NC2=CC=CC=C2N1C(=O)CSCC3=NC(=NC(=N3)NC4=CC=CC=C4)N)C

Isomeric SMILES

CC1(C(=O)NC2=CC=CC=C2N1C(=O)CSCC3=NC(=NC(=N3)NC4=CC=CC=C4)N)C

InChI

InChI=1S/C22H23N7O2S/c1-22(2)19(31)25-15-10-6-7-11-16(15)29(22)18(30)13-32-12-17-26-20(23)28-21(27-17)24-14-8-4-3-5-9-14/h3-11H,12-13H2,1-2H3,(H,25,31)(H3,23,24,26,27,28)