2-methyl-N-[(3S)-2-oxidanylidene-1-(1-propan-2-ylpiperidin-4-yl)piperidin-3-yl]quinoline-6-sulfonamide

Systemtic Name: 2-methyl-N-[(3S)-2-oxidanylidene-1-(1-propan-2-ylpiperidin-4-yl)piperidin-3-yl]quinoline-6-sulfonamide Openeye Name: N-[(3S)-1-(1-isopropyl-4-piperidyl)-2-oxo-3-piperidyl]-2-methyl-quinoline-6-sulfonamide CAS Name: 2-methyl-N-[(3S)-2-oxo-1-(1-propan-2-yl-4-piperidinyl)-3-piperidinyl]-6-quinolinesulfonamide IUPAC Name: 2-methyl-N-[(3S)-2-oxo-1-(1-propan-2-ylpiperidin-4-yl)piperidin-3-yl]quinoline-6-sulfonamide Traditional Name: N-[(3S)-1-(1-isopropyl-4-piperidyl)-2-keto-3-piperidyl]-2-methyl-quinoline-6-sulfonamide Formula: C23H32N4O3S MolecularWeight: 444.59018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C=C(C=C2)S(=O)(=O)NC3CCCN(C3=O)C4CCN(CC4)C(C)C

Isomeric SMILES

CC1=NC2=C(C=C1)C=C(C=C2)S(=O)(=O)N[C@H]3CCCN(C3=O)C4CCN(CC4)C(C)C

InChI

InChI=1S/C23H32N4O3S/c1-16(2)26-13-10-19(11-14-26)27-12-4-5-22(23(27)28)25-31(29,30)20-8-9-21-18(15-20)7-6-17(3)24-21/h6-9,15-16,19,22,25H,4-5,10-14H2,1-3H3/t22-/m0/s1