[1-[2-[2-azanyl-4-(1,3-dihydroisoindol-2-ylcarbonyl)quinazolin-6-yl]phenyl]sulfonylpiperidin-4-yl] 2-azanylethanoate

Systemtic Name: [1-[2-[2-azanyl-4-(1,3-dihydroisoindol-2-ylcarbonyl)quinazolin-6-yl]phenyl]sulfonylpiperidin-4-yl] 2-azanylethanoate Openeye Name: [1-[2-[2-amino-4-(isoindoline-2-carbonyl)quinazolin-6-yl]phenyl]sulfonyl-4-piperidyl] 2-aminoacetate CAS Name: 2-aminoacetic acid [1-[2-[2-amino-4-[1,3-dihydroisoindol-2-yl(oxo)methyl]-6-quinazolinyl]phenyl]sulfonyl-4-piperidinyl] ester IUPAC Name: [1-[2-[2-amino-4-(1,3-dihydroisoindole-2-carbonyl)quinazolin-6-yl]phenyl]sulfonylpiperidin-4-yl] 2-aminoacetate Traditional Name: 2-aminoacetic acid [1-[2-[2-amino-4-(isoindoline-2-carbonyl)quinazolin-6-yl]phenyl]sulfonyl-4-piperidyl] ester Formula: C30H30N6O5S MolecularWeight: 586.6614

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OC(=O)CN)S(=O)(=O)C2=CC=CC=C2C3=CC4=C(C=C3)N=C(N=C4C(=O)N5CC6=CC=CC=C6C5)N

Isomeric SMILES

C1CN(CCC1OC(=O)CN)S(=O)(=O)C2=CC=CC=C2C3=CC4=C(C=C3)N=C(N=C4C(=O)N5CC6=CC=CC=C6C5)N

InChI

InChI=1S/C30H30N6O5S/c31-16-27(37)41-22-11-13-36(14-12-22)42(39,40)26-8-4-3-7-23(26)19-9-10-25-24(15-19)28(34-30(32)33-25)29(38)35-17-20-5-1-2-6-21(20)18-35/h1-10,15,22H,11-14,16-18,31H2,(H2,32,33,34)