(2S)-N-cyclooctyl-1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-cyclooctyl-1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)pyrrolidine-2-carboxamide Openeye Name: (2S)-N-cyclooctyl-1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)pyrrolidine-2-carboxamide CAS Name: (2S)-N-cyclooctyl-1-(4-methyl-7-methylsulfonyl-2-quinazolinyl)-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-cyclooctyl-1-(4-methyl-7-methylsulfonylquinazolin-2-yl)pyrrolidine-2-carboxamide Traditional Name: (2S)-N-cyclooctyl-1-(7-mesyl-4-methyl-quinazolin-2-yl)pyrrolidine-2-carboxamide Formula: C23H32N4O3S MolecularWeight: 444.59018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=C1C=CC(=C2)S(=O)(=O)C)N3CCCC3C(=O)NC4CCCCCCC4

Isomeric SMILES

CC1=NC(=NC2=C1C=CC(=C2)S(=O)(=O)C)N3CCC[C@H]3C(=O)NC4CCCCCCC4

InChI

InChI=1S/C23H32N4O3S/c1-16-19-13-12-18(31(2,29)30)15-20(19)26-23(24-16)27-14-8-11-21(27)22(28)25-17-9-6-4-3-5-7-10-17/h12-13,15,17,21H,3-11,14H2,1-2H3,(H,25,28)/t21-/m0/s1