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

Systemtic Name: N-(1,3-benzothiazol-2-yl)-4-bromanyl-3-(4-methylpiperidin-1-yl)sulfonyl-benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-4-bromo-3-[(4-methyl-1-piperidyl)sulfonyl]benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-4-bromo-3-[(4-methyl-1-piperidinyl)sulfonyl]benzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-4-bromo-3-(4-methylpiperidin-1-yl)sulfonylbenzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-bromo-3-(4-methylpiperidino)sulfonyl-benzamide Formula: C20H20BrN3O3S2 MolecularWeight: 494.4251

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=NC4=CC=CC=C4S3)Br

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=NC4=CC=CC=C4S3)Br

InChI

InChI=1S/C20H20BrN3O3S2/c1-13-8-10-24(11-9-13)29(26,27)18-12-14(6-7-15(18)21)19(25)23-20-22-16-4-2-3-5-17(16)28-20/h2-7,12-13H,8-11H2,1H3,(H,22,23,25)