2-[1-azanyl-1-oxidanylidene-6-[4-(piperidin-1-ylmethyl)pyridin-2-yl]oxy-hexan-2-yl]sulfanylethyl ethanoate

Systemtic Name: 2-[1-azanyl-1-oxidanylidene-6-[4-(piperidin-1-ylmethyl)pyridin-2-yl]oxy-hexan-2-yl]sulfanylethyl ethanoate Openeye Name: 2-[1-carbamoyl-5-[[4-(1-piperidylmethyl)-2-pyridyl]oxy]pentyl]sulfanylethyl acetate CAS Name: acetic acid 2-[[1-amino-1-oxo-6-[[4-(1-piperidinylmethyl)-2-pyridinyl]oxy]hexan-2-yl]thio]ethyl ester IUPAC Name: 2-[1-amino-1-oxo-6-[4-(piperidin-1-ylmethyl)pyridin-2-yl]oxyhexan-2-yl]sulfanylethyl acetate Traditional Name: acetic acid 2-[[1-carbamoyl-5-[[4-(piperidinomethyl)-2-pyridyl]oxy]pentyl]thio]ethyl ester Formula: C21H33N3O4S MolecularWeight: 423.56942

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCSC(CCCCOC1=NC=CC(=C1)CN2CCCCC2)C(=O)N

Isomeric SMILES

CC(=O)OCCSC(CCCCOC1=NC=CC(=C1)CN2CCCCC2)C(=O)N

InChI

InChI=1S/C21H33N3O4S/c1-17(25)27-13-14-29-19(21(22)26)7-3-6-12-28-20-15-18(8-9-23-20)16-24-10-4-2-5-11-24/h8-9,15,19H,2-7,10-14,16H2,1H3,(H2,22,26)