1-[2-(1,3-benzothiazol-2-ylsulfanylmethyl)phenyl]-3,3-diethyl-azetidine-2,4-dione

Systemtic Name: 1-[2-(1,3-benzothiazol-2-ylsulfanylmethyl)phenyl]-3,3-diethyl-azetidine-2,4-dione Openeye Name: 1-[2-(1,3-benzothiazol-2-ylsulfanylmethyl)phenyl]-3,3-diethyl-azetidine-2,4-dione CAS Name: 1-[2-[(1,3-benzothiazol-2-ylthio)methyl]phenyl]-3,3-diethylazetidine-2,4-dione IUPAC Name: 1-[2-(1,3-benzothiazol-2-ylsulfanylmethyl)phenyl]-3,3-diethylazetidine-2,4-dione Traditional Name: 1-[2-[(1,3-benzothiazol-2-ylthio)methyl]phenyl]-3,3-diethyl-azetidine-2,4-quinone Formula: C21H20N2O2S2 MolecularWeight: 396.5257

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=O)N(C1=O)C2=CC=CC=C2CSC3=NC4=CC=CC=C4S3)CC

Isomeric SMILES

CCC1(C(=O)N(C1=O)C2=CC=CC=C2CSC3=NC4=CC=CC=C4S3)CC

InChI

InChI=1S/C21H20N2O2S2/c1-3-21(4-2)18(24)23(19(21)25)16-11-7-5-9-14(16)13-26-20-22-15-10-6-8-12-17(15)27-20/h5-12H,3-4,13H2,1-2H3