N-(2-methyl-1,3-benzothiazol-5-yl)-4-[(2S)-2-methylpiperidin-1-yl]sulfonyl-benzamide

Systemtic Name: N-(2-methyl-1,3-benzothiazol-5-yl)-4-[(2S)-2-methylpiperidin-1-yl]sulfonyl-benzamide Openeye Name: N-(2-methyl-1,3-benzothiazol-5-yl)-4-[[(2S)-2-methyl-1-piperidyl]sulfonyl]benzamide CAS Name: N-(2-methyl-1,3-benzothiazol-5-yl)-4-[[(2S)-2-methyl-1-piperidinyl]sulfonyl]benzamide IUPAC Name: N-(2-methyl-1,3-benzothiazol-5-yl)-4-[(2S)-2-methylpiperidin-1-yl]sulfonylbenzamide Traditional Name: N-(2-methyl-1,3-benzothiazol-5-yl)-4-[(2S)-2-methylpiperidino]sulfonyl-benzamide Formula: C21H23N3O3S2 MolecularWeight: 429.55562

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC4=C(C=C3)SC(=N4)C

Isomeric SMILES

C[C@H]1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC4=C(C=C3)SC(=N4)C

InChI

InChI=1S/C21H23N3O3S2/c1-14-5-3-4-12-24(14)29(26,27)18-9-6-16(7-10-18)21(25)23-17-8-11-20-19(13-17)22-15(2)28-20/h6-11,13-14H,3-5,12H2,1-2H3,(H,23,25)/t14-/m0/s1