5-chloranyl-N-[(3S)-2-oxidanylidene-1-(1-propan-2-ylpiperidin-4-yl)piperidin-3-yl]-1-benzothiophene-2-sulfonamide

Systemtic Name: 5-chloranyl-N-[(3S)-2-oxidanylidene-1-(1-propan-2-ylpiperidin-4-yl)piperidin-3-yl]-1-benzothiophene-2-sulfonamide Openeye Name: 5-chloro-N-[(3S)-1-(1-isopropyl-4-piperidyl)-2-oxo-3-piperidyl]benzothiophene-2-sulfonamide CAS Name: 5-chloro-N-[(3S)-2-oxo-1-(1-propan-2-yl-4-piperidinyl)-3-piperidinyl]-1-benzothiophene-2-sulfonamide IUPAC Name: 5-chloro-N-[(3S)-2-oxo-1-(1-propan-2-ylpiperidin-4-yl)piperidin-3-yl]-1-benzothiophene-2-sulfonamide Traditional Name: 5-chloro-N-[(3S)-1-(1-isopropyl-4-piperidyl)-2-keto-3-piperidyl]benzothiophene-2-sulfonamide Formula: C21H28ClN3O3S2 MolecularWeight: 470.04832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCC(CC1)N2CCCC(C2=O)NS(=O)(=O)C3=CC4=C(S3)C=CC(=C4)Cl

Isomeric SMILES

CC(C)N1CCC(CC1)N2CCC[C@@H](C2=O)NS(=O)(=O)C3=CC4=C(S3)C=CC(=C4)Cl

InChI

InChI=1S/C21H28ClN3O3S2/c1-14(2)24-10-7-17(8-11-24)25-9-3-4-18(21(25)26)23-30(27,28)20-13-15-12-16(22)5-6-19(15)29-20/h5-6,12-14,17-18,23H,3-4,7-11H2,1-2H3/t18-/m0/s1