N-[2-(4-chlorophenyl)sulfanylphenyl]-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanamide Openeye Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide CAS Name: N-[2-[(4-chlorophenyl)thio]phenyl]-2-[(3S)-3-methyl-1-piperidin-1-iumyl]acetamide IUPAC Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide Traditional Name: N-[2-[(4-chlorophenyl)thio]phenyl]-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide Formula: C20H24ClN2OS+ MolecularWeight: 375.93536

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC(=O)NC2=CC=CC=C2SC3=CC=C(C=C3)Cl

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC(=O)NC2=CC=CC=C2SC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H23ClN2OS/c1-15-5-4-12-23(13-15)14-20(24)22-18-6-2-3-7-19(18)25-17-10-8-16(21)9-11-17/h2-3,6-11,15H,4-5,12-14H2,1H3,(H,22,24)/p+1/t15-/m0/s1