N-(5-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(1,2,3,4-tetrazol-1-yl)propanamide

Systemtic Name: N-(5-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(1,2,3,4-tetrazol-1-yl)propanamide Openeye Name: N-(5-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(tetrazol-1-yl)propanamide CAS Name: N-(5-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(1-tetrazolyl)propanamide IUPAC Name: N-(5-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(tetrazol-1-yl)propanamide Traditional Name: N-(5-mesyl-1,3-benzothiazol-2-yl)-3-(tetrazol-1-yl)propionamide Formula: C12H12N6O3S2 MolecularWeight: 352.39208

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)SC(=N2)NC(=O)CCN3C=NN=N3

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)SC(=N2)NC(=O)CCN3C=NN=N3

InChI

InChI=1S/C12H12N6O3S2/c1-23(20,21)8-2-3-10-9(6-8)14-12(22-10)15-11(19)4-5-18-7-13-16-17-18/h2-3,6-7H,4-5H2,1H3,(H,14,15,19)