[2-azanyl-6-[2-(3-oxidanylpyrrolidin-1-yl)sulfonylphenyl]quinazolin-4-yl]-(1,3-dihydroisoindol-2-yl)methanone

Systemtic Name: [2-azanyl-6-[2-(3-oxidanylpyrrolidin-1-yl)sulfonylphenyl]quinazolin-4-yl]-(1,3-dihydroisoindol-2-yl)methanone Openeye Name: [2-amino-6-[2-(3-hydroxypyrrolidin-1-yl)sulfonylphenyl]quinazolin-4-yl]-isoindolin-2-yl-methanone CAS Name: [2-amino-6-[2-[(3-hydroxy-1-pyrrolidinyl)sulfonyl]phenyl]-4-quinazolinyl]-(1,3-dihydroisoindol-2-yl)methanone IUPAC Name: [2-amino-6-[2-(3-hydroxypyrrolidin-1-yl)sulfonylphenyl]quinazolin-4-yl]-(1,3-dihydroisoindol-2-yl)methanone Traditional Name: [2-amino-6-[2-(3-hydroxypyrrolidino)sulfonylphenyl]quinazolin-4-yl]-isoindolin-2-yl-methanone Formula: C27H25N5O4S MolecularWeight: 515.5835

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1O)S(=O)(=O)C2=CC=CC=C2C3=CC4=C(C=C3)N=C(N=C4C(=O)N5CC6=CC=CC=C6C5)N

Isomeric SMILES

C1CN(CC1O)S(=O)(=O)C2=CC=CC=C2C3=CC4=C(C=C3)N=C(N=C4C(=O)N5CC6=CC=CC=C6C5)N

InChI

InChI=1S/C27H25N5O4S/c28-27-29-23-10-9-17(21-7-3-4-8-24(21)37(35,36)32-12-11-20(33)16-32)13-22(23)25(30-27)26(34)31-14-18-5-1-2-6-19(18)15-31/h1-10,13,20,33H,11-12,14-16H2,(H2,28,29,30)