5-chloranyl-2-ethylsulfonyl-N-(3-imidazol-1-ylpropyl)pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-2-ethylsulfonyl-N-(3-imidazol-1-ylpropyl)pyrimidine-4-carboxamide Openeye Name: 5-chloro-2-ethylsulfonyl-N-(3-imidazol-1-ylpropyl)pyrimidine-4-carboxamide CAS Name: 5-chloro-2-ethylsulfonyl-N-[3-(1-imidazolyl)propyl]-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-2-ethylsulfonyl-N-(3-imidazol-1-ylpropyl)pyrimidine-4-carboxamide Traditional Name: 5-chloro-2-esyl-N-(3-imidazol-1-ylpropyl)pyrimidine-4-carboxamide Formula: C13H16ClN5O3S MolecularWeight: 357.81584

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=NC=C(C(=N1)C(=O)NCCCN2C=CN=C2)Cl

Isomeric SMILES

CCS(=O)(=O)C1=NC=C(C(=N1)C(=O)NCCCN2C=CN=C2)Cl

InChI

InChI=1S/C13H16ClN5O3S/c1-2-23(21,22)13-17-8-10(14)11(18-13)12(20)16-4-3-6-19-7-5-15-9-19/h5,7-9H,2-4,6H2,1H3,(H,16,20)