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

Systemtic Name: 5-chloranyl-3-methyl-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]-3-methyl-benzothiophene-2-sulfonamide CAS Name: 5-chloro-3-methyl-N-[(3S)-2-oxo-1-(1-propan-2-yl-4-piperidinyl)-3-piperidinyl]-1-benzothiophene-2-sulfonamide IUPAC Name: 5-chloro-3-methyl-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]-3-methyl-benzothiophene-2-sulfonamide Formula: C22H30ClN3O3S2 MolecularWeight: 484.0749

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C=C(C=C2)Cl)S(=O)(=O)NC3CCCN(C3=O)C4CCN(CC4)C(C)C

Isomeric SMILES

CC1=C(SC2=C1C=C(C=C2)Cl)S(=O)(=O)N[C@H]3CCCN(C3=O)C4CCN(CC4)C(C)C

InChI

InChI=1S/C22H30ClN3O3S2/c1-14(2)25-11-8-17(9-12-25)26-10-4-5-19(21(26)27)24-31(28,29)22-15(3)18-13-16(23)6-7-20(18)30-22/h6-7,13-14,17,19,24H,4-5,8-12H2,1-3H3/t19-/m0/s1