4-[2-(1,3-benzothiazol-2-ylsulfanyl)propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one

Systemtic Name: 4-[2-(1,3-benzothiazol-2-ylsulfanyl)propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Openeye Name: 4-[2-(1,3-benzothiazol-2-ylsulfanyl)propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one CAS Name: 4-[2-(1,3-benzothiazol-2-ylthio)-1-oxopropyl]-3,3-dimethyl-1H-quinoxalin-2-one IUPAC Name: 4-[2-(1,3-benzothiazol-2-ylsulfanyl)propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Traditional Name: 4-[2-(1,3-benzothiazol-2-ylthio)propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Formula: C20H19N3O2S2 MolecularWeight: 397.51376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1C2=CC=CC=C2NC(=O)C1(C)C)SC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(C(=O)N1C2=CC=CC=C2NC(=O)C1(C)C)SC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H19N3O2S2/c1-12(26-19-22-14-9-5-7-11-16(14)27-19)17(24)23-15-10-6-4-8-13(15)21-18(25)20(23,2)3/h4-12H,1-3H3,(H,21,25)