N-[4-[(2S)-2-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonylphenyl]ethanamide

Systemtic Name: N-[4-[(2S)-2-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonylphenyl]ethanamide Openeye Name: N-[4-[[(2S)-2-(1,3-benzothiazol-2-yl)-1-piperidyl]sulfonyl]phenyl]acetamide CAS Name: N-[4-[[(2S)-2-(1,3-benzothiazol-2-yl)-1-piperidinyl]sulfonyl]phenyl]acetamide IUPAC Name: N-[4-[(2S)-2-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonylphenyl]acetamide Traditional Name: N-[4-[(2S)-2-(1,3-benzothiazol-2-yl)piperidino]sulfonylphenyl]acetamide Formula: C20H21N3O3S2 MolecularWeight: 415.52904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC[C@H]2C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H21N3O3S2/c1-14(24)21-15-9-11-16(12-10-15)28(25,26)23-13-5-4-7-18(23)20-22-17-6-2-3-8-19(17)27-20/h2-3,6,8-12,18H,4-5,7,13H2,1H3,(H,21,24)/t18-/m0/s1