N-[(2S)-1-(4-methylpiperidin-1-yl)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]naphthalene-2-sulfonamide

Systemtic Name: N-[(2S)-1-(4-methylpiperidin-1-yl)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]naphthalene-2-sulfonamide Openeye Name: N-[(1S)-1-(4-methylpiperidine-1-carbonyl)-3-methylsulfanyl-propyl]naphthalene-2-sulfonamide CAS Name: N-[(2S)-1-(4-methyl-1-piperidinyl)-4-(methylthio)-1-oxobutan-2-yl]-2-naphthalenesulfonamide IUPAC Name: N-[(2S)-1-(4-methylpiperidin-1-yl)-4-methylsulfanyl-1-oxobutan-2-yl]naphthalene-2-sulfonamide Traditional Name: N-[(1S)-1-(4-methylpiperidine-1-carbonyl)-3-(methylthio)propyl]naphthalene-2-sulfonamide Formula: C21H28N2O3S2 MolecularWeight: 420.58862

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C(CCSC)NS(=O)(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CC1CCN(CC1)C(=O)[C@H](CCSC)NS(=O)(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H28N2O3S2/c1-16-9-12-23(13-10-16)21(24)20(11-14-27-2)22-28(25,26)19-8-7-17-5-3-4-6-18(17)15-19/h3-8,15-16,20,22H,9-14H2,1-2H3/t20-/m0/s1