2-oxidanylidene-N-[(2R)-4-phenylbutan-2-yl]-3H-1,3-benzothiazole-6-sulfonamide

Systemtic Name: 2-oxidanylidene-N-[(2R)-4-phenylbutan-2-yl]-3H-1,3-benzothiazole-6-sulfonamide Openeye Name: N-[(1R)-1-methyl-3-phenyl-propyl]-2-oxo-3H-1,3-benzothiazole-6-sulfonamide CAS Name: 2-oxo-N-[(2R)-4-phenylbutan-2-yl]-3H-1,3-benzothiazole-6-sulfonamide IUPAC Name: 2-oxo-N-[(2R)-4-phenylbutan-2-yl]-3H-1,3-benzothiazole-6-sulfonamide Traditional Name: 2-keto-N-[(1R)-1-methyl-3-phenyl-propyl]-3H-1,3-benzothiazole-6-sulfonamide Formula: C17H18N2O3S2 MolecularWeight: 362.46642

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NS(=O)(=O)C2=CC3=C(C=C2)NC(=O)S3

Isomeric SMILES

C[C@H](CCC1=CC=CC=C1)NS(=O)(=O)C2=CC3=C(C=C2)NC(=O)S3

InChI

InChI=1S/C17H18N2O3S2/c1-12(7-8-13-5-3-2-4-6-13)19-24(21,22)14-9-10-15-16(11-14)23-17(20)18-15/h2-6,9-12,19H,7-8H2,1H3,(H,18,20)/t12-/m1/s1