2-pent-3-ynylsulfonyl-1,3-benzothiazole

Systemtic Name: 2-pent-3-ynylsulfonyl-1,3-benzothiazole Openeye Name: 2-pent-3-ynylsulfonyl-1,3-benzothiazole CAS Name: 2-pent-3-ynylsulfonyl-1,3-benzothiazole IUPAC Name: 2-pent-3-ynylsulfonyl-1,3-benzothiazole Traditional Name: 2-pent-3-ynylsulfonyl-1,3-benzothiazole Formula: C12H11NO2S2 MolecularWeight: 265.35124

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCCS(=O)(=O)C1=NC2=CC=CC=C2S1

Isomeric SMILES

CC#CCCS(=O)(=O)C1=NC2=CC=CC=C2S1

InChI

InChI=1S/C12H11NO2S2/c1-2-3-6-9-17(14,15)12-13-10-7-4-5-8-11(10)16-12/h4-5,7-8H,6,9H2,1H3