N-[5-[(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonyl-2-methoxy-phenyl]ethanamide

Systemtic Name: N-[5-[(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonyl-2-methoxy-phenyl]ethanamide Openeye Name: N-[5-[[(3S)-3-(1,3-benzothiazol-2-yl)-1-piperidyl]sulfonyl]-2-methoxy-phenyl]acetamide CAS Name: N-[5-[[(3S)-3-(1,3-benzothiazol-2-yl)-1-piperidinyl]sulfonyl]-2-methoxyphenyl]acetamide IUPAC Name: N-[5-[(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonyl-2-methoxyphenyl]acetamide Traditional Name: N-[5-[(3S)-3-(1,3-benzothiazol-2-yl)piperidino]sulfonyl-2-methoxy-phenyl]acetamide Formula: C21H23N3O4S2 MolecularWeight: 445.55502

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CCCC(C2)C3=NC4=CC=CC=C4S3)OC

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CCC[C@@H](C2)C3=NC4=CC=CC=C4S3)OC

InChI

InChI=1S/C21H23N3O4S2/c1-14(25)22-18-12-16(9-10-19(18)28-2)30(26,27)24-11-5-6-15(13-24)21-23-17-7-3-4-8-20(17)29-21/h3-4,7-10,12,15H,5-6,11,13H2,1-2H3,(H,22,25)/t15-/m0/s1