2-[1-[2-(benzimidazol-1-yl)ethylsulfonyl]piperidin-3-yl]-1,3-benzoxazole

Systemtic Name: 2-[1-[2-(benzimidazol-1-yl)ethylsulfonyl]piperidin-3-yl]-1,3-benzoxazole Openeye Name: 2-[1-[2-(benzimidazol-1-yl)ethylsulfonyl]-3-piperidyl]-1,3-benzoxazole CAS Name: 2-[1-[2-(1-benzimidazolyl)ethylsulfonyl]-3-piperidinyl]-1,3-benzoxazole IUPAC Name: 2-[1-[2-(benzimidazol-1-yl)ethylsulfonyl]piperidin-3-yl]-1,3-benzoxazole Traditional Name: 2-[1-[2-(benzimidazol-1-yl)ethylsulfonyl]-3-piperidyl]-1,3-benzoxazole Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)CCN2C=NC3=CC=CC=C32)C4=NC5=CC=CC=C5O4

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)CCN2C=NC3=CC=CC=C32)C4=NC5=CC=CC=C5O4

InChI

InChI=1S/C21H22N4O3S/c26-29(27,13-12-24-15-22-17-7-1-3-9-19(17)24)25-11-5-6-16(14-25)21-23-18-8-2-4-10-20(18)28-21/h1-4,7-10,15-16H,5-6,11-14H2