6-chloranyl-N-(cyanomethyl)-N-[(3S)-2-oxidanylidene-1-(1-propan-2-ylpiperidin-4-yl)piperidin-3-yl]naphthalene-2-sulfonamide

Systemtic Name: 6-chloranyl-N-(cyanomethyl)-N-[(3S)-2-oxidanylidene-1-(1-propan-2-ylpiperidin-4-yl)piperidin-3-yl]naphthalene-2-sulfonamide Openeye Name: 6-chloro-N-(cyanomethyl)-N-[(3S)-1-(1-isopropyl-4-piperidyl)-2-oxo-3-piperidyl]naphthalene-2-sulfonamide CAS Name: 6-chloro-N-(cyanomethyl)-N-[(3S)-2-oxo-1-(1-propan-2-yl-4-piperidinyl)-3-piperidinyl]-2-naphthalenesulfonamide IUPAC Name: 6-chloro-N-(cyanomethyl)-N-[(3S)-2-oxo-1-(1-propan-2-ylpiperidin-4-yl)piperidin-3-yl]naphthalene-2-sulfonamide Traditional Name: 6-chloro-N-(cyanomethyl)-N-[(3S)-1-(1-isopropyl-4-piperidyl)-2-keto-3-piperidyl]naphthalene-2-sulfonamide Formula: C25H31ClN4O3S MolecularWeight: 503.05664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCC(CC1)N2CCCC(C2=O)N(CC#N)S(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl

Isomeric SMILES

CC(C)N1CCC(CC1)N2CCC[C@@H](C2=O)N(CC#N)S(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl

InChI

InChI=1S/C25H31ClN4O3S/c1-18(2)28-13-9-22(10-14-28)29-12-3-4-24(25(29)31)30(15-11-27)34(32,33)23-8-6-19-16-21(26)7-5-20(19)17-23/h5-8,16-18,22,24H,3-4,9-10,12-15H2,1-2H3/t24-/m0/s1