N-(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)-3-(2,6-dimethyl-4-oxidanylidene-1H-pyrimidin-5-yl)propanamide

Systemtic Name: N-(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)-3-(2,6-dimethyl-4-oxidanylidene-1H-pyrimidin-5-yl)propanamide Openeye Name: N-[4-chloro-3-(1-piperidylsulfonyl)phenyl]-3-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)propanamide CAS Name: N-[4-chloro-3-(1-piperidinylsulfonyl)phenyl]-3-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)propanamide IUPAC Name: N-(4-chloro-3-piperidin-1-ylsulfonylphenyl)-3-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)propanamide Traditional Name: N-(4-chloro-3-piperidinosulfonyl-phenyl)-3-(4-keto-2,6-dimethyl-1H-pyrimidin-5-yl)propionamide Formula: C20H25ClN4O4S MolecularWeight: 452.9549

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)C)CCC(=O)NC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C(=O)N=C(N1)C)CCC(=O)NC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H25ClN4O4S/c1-13-16(20(27)23-14(2)22-13)7-9-19(26)24-15-6-8-17(21)18(12-15)30(28,29)25-10-4-3-5-11-25/h6,8,12H,3-5,7,9-11H2,1-2H3,(H,24,26)(H,22,23,27)