N-(1,3-benzothiazol-2-ylmethyl)-4-methyl-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-4-methyl-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-4-methyl-3-(1-piperidylsulfonyl)benzamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-4-methyl-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-4-methyl-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-4-methyl-3-piperidinosulfonyl-benzamide Formula: C21H23N3O3S2 MolecularWeight: 429.55562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC2=NC3=CC=CC=C3S2)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC2=NC3=CC=CC=C3S2)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C21H23N3O3S2/c1-15-9-10-16(13-19(15)29(26,27)24-11-5-2-6-12-24)21(25)22-14-20-23-17-7-3-4-8-18(17)28-20/h3-4,7-10,13H,2,5-6,11-12,14H2,1H3,(H,22,25)