4-(1,3-benzothiazol-2-ylsulfanyl)-N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-methyl-butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-methyl-butanamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-[(3S)-1,1-dioxothiolan-3-yl]-N-methyl-butanamide CAS Name: 4-(1,3-benzothiazol-2-ylthio)-N-[(3S)-1,1-dioxo-3-thiolanyl]-N-methylbutanamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-[(3S)-1,1-dioxothiolan-3-yl]-N-methylbutanamide Traditional Name: 4-(1,3-benzothiazol-2-ylthio)-N-[(3S)-1,1-diketothiolan-3-yl]-N-methyl-butyramide Formula: C16H20N2O3S3 MolecularWeight: 384.5366

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCS(=O)(=O)C1)C(=O)CCCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CN([C@H]1CCS(=O)(=O)C1)C(=O)CCCSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H20N2O3S3/c1-18(12-8-10-24(20,21)11-12)15(19)7-4-9-22-16-17-13-5-2-3-6-14(13)23-16/h2-3,5-6,12H,4,7-11H2,1H3/t12-/m0/s1