[2-(2,5-dimethoxyphenyl)sulfanylpyridin-3-yl]-(2-ethylpiperidin-1-yl)methanone

Systemtic Name: [2-(2,5-dimethoxyphenyl)sulfanylpyridin-3-yl]-(2-ethylpiperidin-1-yl)methanone Openeye Name: [2-(2,5-dimethoxyphenyl)sulfanyl-3-pyridyl]-(2-ethyl-1-piperidyl)methanone CAS Name: [2-[(2,5-dimethoxyphenyl)thio]-3-pyridinyl]-(2-ethyl-1-piperidinyl)methanone IUPAC Name: [2-(2,5-dimethoxyphenyl)sulfanylpyridin-3-yl]-(2-ethylpiperidin-1-yl)methanone Traditional Name: [2-[(2,5-dimethoxyphenyl)thio]-3-pyridyl]-(2-ethylpiperidino)methanone Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)C2=C(N=CC=C2)SC3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CCC1CCCCN1C(=O)C2=C(N=CC=C2)SC3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C21H26N2O3S/c1-4-15-8-5-6-13-23(15)21(24)17-9-7-12-22-20(17)27-19-14-16(25-2)10-11-18(19)26-3/h7,9-12,14-15H,4-6,8,13H2,1-3H3