N-(6-acetamido-1,3-benzothiazol-2-yl)-4-(3-methylpiperidin-1-yl)sulfonyl-benzamide

Systemtic Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-4-(3-methylpiperidin-1-yl)sulfonyl-benzamide Openeye Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-4-[(3-methyl-1-piperidyl)sulfonyl]benzamide CAS Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-4-[(3-methyl-1-piperidinyl)sulfonyl]benzamide IUPAC Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-4-(3-methylpiperidin-1-yl)sulfonylbenzamide Traditional Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-4-(3-methylpiperidino)sulfonyl-benzamide Formula: C22H24N4O4S2 MolecularWeight: 472.58036

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NC4=C(S3)C=C(C=C4)NC(=O)C

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NC4=C(S3)C=C(C=C4)NC(=O)C

InChI

InChI=1S/C22H24N4O4S2/c1-14-4-3-11-26(13-14)32(29,30)18-8-5-16(6-9-18)21(28)25-22-24-19-10-7-17(23-15(2)27)12-20(19)31-22/h5-10,12,14H,3-4,11,13H2,1-2H3,(H,23,27)(H,24,25,28)