2-azanyl-N-[1-[4-(2-methylsulfonylphenyl)phenyl]carbonylpyrrolidin-3-yl]pyrimidine-5-sulfonamide

Systemtic Name: 2-azanyl-N-[1-[4-(2-methylsulfonylphenyl)phenyl]carbonylpyrrolidin-3-yl]pyrimidine-5-sulfonamide Openeye Name: 2-amino-N-[1-[4-(2-methylsulfonylphenyl)benzoyl]pyrrolidin-3-yl]pyrimidine-5-sulfonamide CAS Name: 2-amino-N-[1-[[4-(2-methylsulfonylphenyl)phenyl]-oxomethyl]-3-pyrrolidinyl]-5-pyrimidinesulfonamide IUPAC Name: 2-amino-N-[1-[4-(2-methylsulfonylphenyl)benzoyl]pyrrolidin-3-yl]pyrimidine-5-sulfonamide Traditional Name: 2-amino-N-[1-[4-(2-mesylphenyl)benzoyl]pyrrolidin-3-yl]pyrimidine-5-sulfonamide Formula: C22H23N5O5S2 MolecularWeight: 501.57852

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C2=CC=C(C=C2)C(=O)N3CCC(C3)NS(=O)(=O)C4=CN=C(N=C4)N

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C2=CC=C(C=C2)C(=O)N3CCC(C3)NS(=O)(=O)C4=CN=C(N=C4)N

InChI

InChI=1S/C22H23N5O5S2/c1-33(29,30)20-5-3-2-4-19(20)15-6-8-16(9-7-15)21(28)27-11-10-17(14-27)26-34(31,32)18-12-24-22(23)25-13-18/h2-9,12-13,17,26H,10-11,14H2,1H3,(H2,23,24,25)