7-azanyl-6-[[(Z)-(5-tert-butyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]-3-(2-methylsulfanylethyl)-1H-quinoxalin-2-one

Systemtic Name: 7-azanyl-6-[[(Z)-(5-tert-butyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]-3-(2-methylsulfanylethyl)-1H-quinoxalin-2-one Openeye Name: 7-amino-6-[[(Z)-(5-tert-butyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]amino]-3-(2-methylsulfanylethyl)-1H-quinoxalin-2-one CAS Name: 7-amino-6-[[(Z)-(5-tert-butyl-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]-3-[2-(methylthio)ethyl]-1H-quinoxalin-2-one IUPAC Name: 7-amino-6-[[(Z)-(5-tert-butyl-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]-3-(2-methylsulfanylethyl)-1H-quinoxalin-2-one Traditional Name: 7-amino-6-[[(Z)-(5-tert-butyl-6-keto-cyclohexa-2,4-dien-1-ylidene)methyl]amino]-3-[2-(methylthio)ethyl]-1H-quinoxalin-2-one Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC(=CNC2=C(C=C3C(=C2)N=C(C(=O)N3)CCSC)N)C1=O

Isomeric SMILES

CC(C)(C)C1=CC=C/C(=C/NC2=C(C=C3C(=C2)N=C(C(=O)N3)CCSC)N)/C1=O

InChI

InChI=1S/C22H26N4O2S/c1-22(2,3)14-7-5-6-13(20(14)27)12-24-17-11-19-18(10-15(17)23)26-21(28)16(25-19)8-9-29-4/h5-7,10-12,24H,8-9,23H2,1-4H3,(H,26,28)/b13-12-