[3-[4-[(4-phenylmethoxyphenyl)amino]quinazolin-6-yl]furan-2-yl] N-(2-methylsulfonylethyl)carbamate

Systemtic Name: [3-[4-[(4-phenylmethoxyphenyl)amino]quinazolin-6-yl]furan-2-yl] N-(2-methylsulfonylethyl)carbamate Openeye Name: [3-[4-(4-benzyloxyanilino)quinazolin-6-yl]-2-furyl] N-(2-methylsulfonylethyl)carbamate CAS Name: N-(2-methylsulfonylethyl)carbamic acid [3-[4-(4-phenylmethoxyanilino)-6-quinazolinyl]-2-furanyl] ester IUPAC Name: [3-[4-(4-phenylmethoxyanilino)quinazolin-6-yl]furan-2-yl] N-(2-methylsulfonylethyl)carbamate Traditional Name: N-(2-mesylethyl)carbamic acid [3-[4-(4-benzoxyanilino)quinazolin-6-yl]-2-furyl] ester Formula: C29H26N4O6S MolecularWeight: 558.60494

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCNC(=O)OC1=C(C=CO1)C2=CC3=C(C=C2)N=CN=C3NC4=CC=C(C=C4)OCC5=CC=CC=C5

Isomeric SMILES

CS(=O)(=O)CCNC(=O)OC1=C(C=CO1)C2=CC3=C(C=C2)N=CN=C3NC4=CC=C(C=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C29H26N4O6S/c1-40(35,36)16-14-30-29(34)39-28-24(13-15-37-28)21-7-12-26-25(17-21)27(32-19-31-26)33-22-8-10-23(11-9-22)38-18-20-5-3-2-4-6-20/h2-13,15,17,19H,14,16,18H2,1H3,(H,30,34)(H,31,32,33)