2-(2,6-dimethylpyrimidin-4-yl)sulfanyl-N-(3-piperidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: 2-(2,6-dimethylpyrimidin-4-yl)sulfanyl-N-(3-piperidin-1-ylsulfonylphenyl)propanamide Openeye Name: 2-(2,6-dimethylpyrimidin-4-yl)sulfanyl-N-[3-(1-piperidylsulfonyl)phenyl]propanamide CAS Name: 2-[(2,6-dimethyl-4-pyrimidinyl)thio]-N-[3-(1-piperidinylsulfonyl)phenyl]propanamide IUPAC Name: 2-(2,6-dimethylpyrimidin-4-yl)sulfanyl-N-(3-piperidin-1-ylsulfonylphenyl)propanamide Traditional Name: 2-[(2,6-dimethylpyrimidin-4-yl)thio]-N-(3-piperidinosulfonylphenyl)propionamide Formula: C20H26N4O3S2 MolecularWeight: 434.57544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C)SC(C)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=CC(=NC(=N1)C)SC(C)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H26N4O3S2/c1-14-12-19(22-16(3)21-14)28-15(2)20(25)23-17-8-7-9-18(13-17)29(26,27)24-10-5-4-6-11-24/h7-9,12-13,15H,4-6,10-11H2,1-3H3,(H,23,25)