3-azanyl-N-(3-imidazol-1-ylpropyl)-6-(4-pyrrolidin-1-ylsulfonylphenyl)pyrazine-2-carboxamide

Systemtic Name: 3-azanyl-N-(3-imidazol-1-ylpropyl)-6-(4-pyrrolidin-1-ylsulfonylphenyl)pyrazine-2-carboxamide Openeye Name: 3-amino-N-(3-imidazol-1-ylpropyl)-6-(4-pyrrolidin-1-ylsulfonylphenyl)pyrazine-2-carboxamide CAS Name: 3-amino-N-[3-(1-imidazolyl)propyl]-6-[4-(1-pyrrolidinylsulfonyl)phenyl]-2-pyrazinecarboxamide IUPAC Name: 3-amino-N-(3-imidazol-1-ylpropyl)-6-(4-pyrrolidin-1-ylsulfonylphenyl)pyrazine-2-carboxamide Traditional Name: 3-amino-N-(3-imidazol-1-ylpropyl)-6-(4-pyrrolidinosulfonylphenyl)pyrazinamide Formula: C21H25N7O3S MolecularWeight: 455.5333

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=CN=C(C(=N3)C(=O)NCCCN4C=CN=C4)N

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=CN=C(C(=N3)C(=O)NCCCN4C=CN=C4)N

InChI

InChI=1S/C21H25N7O3S/c22-20-19(21(29)24-8-3-10-27-13-9-23-15-27)26-18(14-25-20)16-4-6-17(7-5-16)32(30,31)28-11-1-2-12-28/h4-7,9,13-15H,1-3,8,10-12H2,(H2,22,25)(H,24,29)