methyl 4-[(3-methylpiperidin-4-yl)-[(2-oxidanylidene-3H-benzimidazol-1-yl)sulfonyl]methyl]piperidine-1-carboxylate

Systemtic Name: methyl 4-[(3-methylpiperidin-4-yl)-[(2-oxidanylidene-3H-benzimidazol-1-yl)sulfonyl]methyl]piperidine-1-carboxylate Openeye Name: methyl 4-[(3-methyl-4-piperidyl)-[(2-oxo-3H-benzimidazol-1-yl)sulfonyl]methyl]piperidine-1-carboxylate CAS Name: 4-[(3-methyl-4-piperidinyl)-[(2-oxo-3H-benzimidazol-1-yl)sulfonyl]methyl]-1-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 4-[(3-methylpiperidin-4-yl)-[(2-oxo-3H-benzimidazol-1-yl)sulfonyl]methyl]piperidine-1-carboxylate Traditional Name: 4-[(2-keto-3H-benzimidazol-1-yl)sulfonyl-(3-methyl-4-piperidyl)methyl]piperidine-1-carboxylic acid methyl ester Formula: C21H30N4O5S MolecularWeight: 450.5517

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Descriptors Computed from Structure

Canonical SMILES:

CC1CNCCC1C(C2CCN(CC2)C(=O)OC)S(=O)(=O)N3C4=CC=CC=C4NC3=O

Isomeric SMILES

CC1CNCCC1C(C2CCN(CC2)C(=O)OC)S(=O)(=O)N3C4=CC=CC=C4NC3=O

InChI

InChI=1S/C21H30N4O5S/c1-14-13-22-10-7-16(14)19(15-8-11-24(12-9-15)21(27)30-2)31(28,29)25-18-6-4-3-5-17(18)23-20(25)26/h3-6,14-16,19,22H,7-13H2,1-2H3,(H,23,26)