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

Systemtic Name: [2-azanyl-6-[2-(3-azanylpyrrolidin-1-yl)sulfonylphenyl]quinazolin-4-yl]-(1,3-dihydroisoindol-2-yl)methanone Openeye Name: [2-amino-6-[2-(3-aminopyrrolidin-1-yl)sulfonylphenyl]quinazolin-4-yl]-isoindolin-2-yl-methanone CAS Name: [2-amino-6-[2-[(3-amino-1-pyrrolidinyl)sulfonyl]phenyl]-4-quinazolinyl]-(1,3-dihydroisoindol-2-yl)methanone IUPAC Name: [2-amino-6-[2-(3-aminopyrrolidin-1-yl)sulfonylphenyl]quinazolin-4-yl]-(1,3-dihydroisoindol-2-yl)methanone Traditional Name: [2-amino-6-[2-(3-aminopyrrolidino)sulfonylphenyl]quinazolin-4-yl]-isoindolin-2-yl-methanone Formula: C27H26N6O3S MolecularWeight: 514.59874

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1N)S(=O)(=O)C2=CC=CC=C2C3=CC4=C(C=C3)N=C(N=C4C(=O)N5CC6=CC=CC=C6C5)N

Isomeric SMILES

C1CN(CC1N)S(=O)(=O)C2=CC=CC=C2C3=CC4=C(C=C3)N=C(N=C4C(=O)N5CC6=CC=CC=C6C5)N

InChI

InChI=1S/C27H26N6O3S/c28-20-11-12-33(16-20)37(35,36)24-8-4-3-7-21(24)17-9-10-23-22(13-17)25(31-27(29)30-23)26(34)32-14-18-5-1-2-6-19(18)15-32/h1-10,13,20H,11-12,14-16,28H2,(H2,29,30,31)