N-[(8-methyl-4-pyrrolidin-1-yl-quinazolin-2-yl)methyl]-4-methylsulfonyl-benzenesulfonamide

Systemtic Name: N-[(8-methyl-4-pyrrolidin-1-yl-quinazolin-2-yl)methyl]-4-methylsulfonyl-benzenesulfonamide Openeye Name: N-[(8-methyl-4-pyrrolidin-1-yl-quinazolin-2-yl)methyl]-4-methylsulfonyl-benzenesulfonamide CAS Name: N-[[8-methyl-4-(1-pyrrolidinyl)-2-quinazolinyl]methyl]-4-methylsulfonylbenzenesulfonamide IUPAC Name: N-[(8-methyl-4-pyrrolidin-1-ylquinazolin-2-yl)methyl]-4-methylsulfonylbenzenesulfonamide Traditional Name: 4-mesyl-N-[(8-methyl-4-pyrrolidino-quinazolin-2-yl)methyl]benzenesulfonamide Formula: C21H24N4O4S2 MolecularWeight: 460.56966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(N=C2N3CCCC3)CNS(=O)(=O)C4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CC1=CC=CC2=C1N=C(N=C2N3CCCC3)CNS(=O)(=O)C4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C21H24N4O4S2/c1-15-6-5-7-18-20(15)23-19(24-21(18)25-12-3-4-13-25)14-22-31(28,29)17-10-8-16(9-11-17)30(2,26)27/h5-11,22H,3-4,12-14H2,1-2H3