N-[(2S)-1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]thiophene-2-sulfonamide

Systemtic Name: N-[(2S)-1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]thiophene-2-sulfonamide Openeye Name: N-[(1S)-1-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-2-methyl-propyl]thiophene-2-sulfonamide CAS Name: N-[(2S)-1-[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-3-methyl-1-oxobutan-2-yl]-2-thiophenesulfonamide IUPAC Name: N-[(2S)-1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-methyl-1-oxobutan-2-yl]thiophene-2-sulfonamide Traditional Name: N-[(1S)-1-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-2-methyl-propyl]thiophene-2-sulfonamide Formula: C21H25N3O3S3 MolecularWeight: 463.6365

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCC(CC1)C2=NC3=CC=CC=C3S2)NS(=O)(=O)C4=CC=CS4

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CCC(CC1)C2=NC3=CC=CC=C3S2)NS(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C21H25N3O3S3/c1-14(2)19(23-30(26,27)18-8-5-13-28-18)21(25)24-11-9-15(10-12-24)20-22-16-6-3-4-7-17(16)29-20/h3-8,13-15,19,23H,9-12H2,1-2H3/t19-/m0/s1