2-(6-methylpyrimidin-4-yl)sulfanyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)butanamide

Systemtic Name: 2-(6-methylpyrimidin-4-yl)sulfanyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)butanamide Openeye Name: 2-(6-methylpyrimidin-4-yl)sulfanyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)butanamide CAS Name: 2-[(6-methyl-4-pyrimidinyl)thio]-N-[4-(1-pyrrolidinylsulfonyl)phenyl]butanamide IUPAC Name: 2-(6-methylpyrimidin-4-yl)sulfanyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)butanamide Traditional Name: 2-[(6-methylpyrimidin-4-yl)thio]-N-(4-pyrrolidinosulfonylphenyl)butyramide Formula: C19H24N4O3S2 MolecularWeight: 420.54886

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2)SC3=NC=NC(=C3)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2)SC3=NC=NC(=C3)C

InChI

InChI=1S/C19H24N4O3S2/c1-3-17(27-18-12-14(2)20-13-21-18)19(24)22-15-6-8-16(9-7-15)28(25,26)23-10-4-5-11-23/h6-9,12-13,17H,3-5,10-11H2,1-2H3,(H,22,24)