N-(4-methyl-2-piperidin-1-ylsulfonyl-phenyl)-2-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-methyl-2-piperidin-1-ylsulfonyl-phenyl)-2-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanamide Openeye Name: N-[4-methyl-2-(1-piperidylsulfonyl)phenyl]-2-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetamide CAS Name: N-[4-methyl-2-(1-piperidinylsulfonyl)phenyl]-2-[(6-oxo-1H-pyrimidin-2-yl)thio]acetamide IUPAC Name: N-(4-methyl-2-piperidin-1-ylsulfonylphenyl)-2-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetamide Traditional Name: 2-[(6-keto-1H-pyrimidin-2-yl)thio]-N-(4-methyl-2-piperidinosulfonyl-phenyl)acetamide Formula: C18H22N4O4S2 MolecularWeight: 422.52168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSC2=NC=CC(=O)N2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSC2=NC=CC(=O)N2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C18H22N4O4S2/c1-13-5-6-14(15(11-13)28(25,26)22-9-3-2-4-10-22)20-17(24)12-27-18-19-8-7-16(23)21-18/h5-8,11H,2-4,9-10,12H2,1H3,(H,20,24)(H,19,21,23)