S-[7-oxidanylidene-7-(pyridin-3-ylamino)heptyl] 2-methylpropanethioate

Systemtic Name: S-[7-oxidanylidene-7-(pyridin-3-ylamino)heptyl] 2-methylpropanethioate Openeye Name: S-[7-oxo-7-(3-pyridylamino)heptyl] 2-methylpropanethioate CAS Name: 2-methylpropanethioic acid S-[7-oxo-7-(3-pyridinylamino)heptyl] ester IUPAC Name: S-[7-oxo-7-(pyridin-3-ylamino)heptyl] 2-methylpropanethioate Traditional Name: 2-methylpropanethioic acid S-[7-keto-7-(3-pyridylamino)heptyl] ester Formula: C16H24N2O2S MolecularWeight: 308.43896

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)SCCCCCCC(=O)NC1=CN=CC=C1

Isomeric SMILES

CC(C)C(=O)SCCCCCCC(=O)NC1=CN=CC=C1

InChI

InChI=1S/C16H24N2O2S/c1-13(2)16(20)21-11-6-4-3-5-9-15(19)18-14-8-7-10-17-12-14/h7-8,10,12-13H,3-6,9,11H2,1-2H3,(H,18,19)