N-cyclohexyl-3-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-propanamide

Systemtic Name: N-cyclohexyl-3-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-propanamide Openeye Name: N-cyclohexyl-3-[(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)sulfanyl]propanamide CAS Name: N-cyclohexyl-3-[[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]thio]propanamide IUPAC Name: N-cyclohexyl-3-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylpropanamide Traditional Name: N-cyclohexyl-3-[(5-pyrrolidinosulfonyl-2-pyridyl)thio]propionamide Formula: C18H27N3O3S2 MolecularWeight: 397.55528

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CCSC2=NC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

C1CCC(CC1)NC(=O)CCSC2=NC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C18H27N3O3S2/c22-17(20-15-6-2-1-3-7-15)10-13-25-18-9-8-16(14-19-18)26(23,24)21-11-4-5-12-21/h8-9,14-15H,1-7,10-13H2,(H,20,22)