2-(4-methylpiperidin-1-yl)carbonyl-N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)benzamide

Systemtic Name: 2-(4-methylpiperidin-1-yl)carbonyl-N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)benzamide Openeye Name: 2-(4-methylpiperidine-1-carbonyl)-N-(2-thioxo-3H-1,3-benzothiazol-6-yl)benzamide CAS Name: 2-[(4-methyl-1-piperidinyl)-oxomethyl]-N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)benzamide IUPAC Name: 2-(4-methylpiperidine-1-carbonyl)-N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)benzamide Traditional Name: 2-(4-methylpiperidine-1-carbonyl)-N-(2-thioxo-3H-1,3-benzothiazol-6-yl)benzamide Formula: C21H21N3O2S2 MolecularWeight: 411.54034

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C2=CC=CC=C2C(=O)NC3=CC4=C(C=C3)NC(=S)S4

Isomeric SMILES

CC1CCN(CC1)C(=O)C2=CC=CC=C2C(=O)NC3=CC4=C(C=C3)NC(=S)S4

InChI

InChI=1S/C21H21N3O2S2/c1-13-8-10-24(11-9-13)20(26)16-5-3-2-4-15(16)19(25)22-14-6-7-17-18(12-14)28-21(27)23-17/h2-7,12-13H,8-11H2,1H3,(H,22,25)(H,23,27)