N-(4-dimethylaminophenyl)-2-(5-pyrrolidin-1-ylcarbonylpyridin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(4-dimethylaminophenyl)-2-(5-pyrrolidin-1-ylcarbonylpyridin-2-yl)sulfanyl-propanamide Openeye Name: N-(4-dimethylaminophenyl)-2-[[5-(pyrrolidine-1-carbonyl)-2-pyridyl]sulfanyl]propanamide CAS Name: N-(4-dimethylaminophenyl)-2-[[5-[oxo(1-pyrrolidinyl)methyl]-2-pyridinyl]thio]propanamide IUPAC Name: N-(4-dimethylaminophenyl)-2-[5-(pyrrolidine-1-carbonyl)pyridin-2-yl]sulfanylpropanamide Traditional Name: N-(4-dimethylaminophenyl)-2-[[5-(pyrrolidine-1-carbonyl)-2-pyridyl]thio]propionamide Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)N(C)C)SC2=NC=C(C=C2)C(=O)N3CCCC3

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)N(C)C)SC2=NC=C(C=C2)C(=O)N3CCCC3

InChI

InChI=1S/C21H26N4O2S/c1-15(20(26)23-17-7-9-18(10-8-17)24(2)3)28-19-11-6-16(14-22-19)21(27)25-12-4-5-13-25/h6-11,14-15H,4-5,12-13H2,1-3H3,(H,23,26)