3-[(5-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-(2-piperidin-1-ylethyl)benzamide

Systemtic Name: 3-[(5-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-(2-piperidin-1-ylethyl)benzamide Openeye Name: 3-[(5-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-[2-(1-piperidyl)ethyl]benzamide CAS Name: 3-[[(5-methyl-1,3-benzoxazol-2-yl)thio]methyl]-N-[2-(1-piperidinyl)ethyl]benzamide IUPAC Name: 3-[(5-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-(2-piperidin-1-ylethyl)benzamide Traditional Name: 3-[[(5-methyl-1,3-benzoxazol-2-yl)thio]methyl]-N-(2-piperidinoethyl)benzamide Formula: C23H27N3O2S MolecularWeight: 409.54438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=N2)SCC3=CC=CC(=C3)C(=O)NCCN4CCCCC4

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=N2)SCC3=CC=CC(=C3)C(=O)NCCN4CCCCC4

InChI

InChI=1S/C23H27N3O2S/c1-17-8-9-21-20(14-17)25-23(28-21)29-16-18-6-5-7-19(15-18)22(27)24-10-13-26-11-3-2-4-12-26/h5-9,14-15H,2-4,10-13,16H2,1H3,(H,24,27)