2-acetamido-N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-1,3-benzothiazole-6-carboxamide

Systemtic Name: 2-acetamido-N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-1,3-benzothiazole-6-carboxamide Openeye Name: 2-acetamido-N-[(3S)-1,1-dioxothiolan-3-yl]-1,3-benzothiazole-6-carboxamide CAS Name: 2-acetamido-N-[(3S)-1,1-dioxo-3-thiolanyl]-1,3-benzothiazole-6-carboxamide IUPAC Name: 2-acetamido-N-[(3S)-1,1-dioxothiolan-3-yl]-1,3-benzothiazole-6-carboxamide Traditional Name: 2-acetamido-N-[(3S)-1,1-diketothiolan-3-yl]-1,3-benzothiazole-6-carboxamide Formula: C14H15N3O4S2 MolecularWeight: 353.4166

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC2=C(S1)C=C(C=C2)C(=O)NC3CCS(=O)(=O)C3

Isomeric SMILES

CC(=O)NC1=NC2=C(S1)C=C(C=C2)C(=O)N[C@H]3CCS(=O)(=O)C3

InChI

InChI=1S/C14H15N3O4S2/c1-8(18)15-14-17-11-3-2-9(6-12(11)22-14)13(19)16-10-4-5-23(20,21)7-10/h2-3,6,10H,4-5,7H2,1H3,(H,16,19)(H,15,17,18)/t10-/m0/s1