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

Systemtic Name: 4-[2-[1-(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)ethylsulfanyl]ethanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Openeye Name: 4-[2-[1-(4-amino-6-anilino-1,3,5-triazin-2-yl)ethylsulfanyl]acetyl]-3,3-dimethyl-1H-quinoxalin-2-one CAS Name: 4-[2-[1-(4-amino-6-anilino-1,3,5-triazin-2-yl)ethylthio]-1-oxoethyl]-3,3-dimethyl-1H-quinoxalin-2-one IUPAC Name: 4-[2-[1-(4-amino-6-anilino-1,3,5-triazin-2-yl)ethylsulfanyl]acetyl]-3,3-dimethyl-1H-quinoxalin-2-one Traditional Name: 4-[2-[1-(4-amino-6-anilino-s-triazin-2-yl)ethylthio]acetyl]-3,3-dimethyl-1H-quinoxalin-2-one Formula: C23H25N7O2S MolecularWeight: 463.5553

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=NC(=N1)NC2=CC=CC=C2)N)SCC(=O)N3C4=CC=CC=C4NC(=O)C3(C)C

Isomeric SMILES

CC(C1=NC(=NC(=N1)NC2=CC=CC=C2)N)SCC(=O)N3C4=CC=CC=C4NC(=O)C3(C)C

InChI

InChI=1S/C23H25N7O2S/c1-14(19-27-21(24)29-22(28-19)25-15-9-5-4-6-10-15)33-13-18(31)30-17-12-8-7-11-16(17)26-20(32)23(30,2)3/h4-12,14H,13H2,1-3H3,(H,26,32)(H3,24,25,27,28,29)