3-(4-methylphenyl)sulfanylpropyl N-[2-chloranyl-4-(6,7-dimethoxyquinazolin-4-yl)oxy-phenyl]carbamate

Systemtic Name: 3-(4-methylphenyl)sulfanylpropyl N-[2-chloranyl-4-(6,7-dimethoxyquinazolin-4-yl)oxy-phenyl]carbamate Openeye Name: 3-(p-tolylsulfanyl)propyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxy-phenyl]carbamate CAS Name: N-[2-chloro-4-[(6,7-dimethoxy-4-quinazolinyl)oxy]phenyl]carbamic acid 3-[(4-methylphenyl)thio]propyl ester IUPAC Name: 3-(4-methylphenyl)sulfanylpropyl N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamate Traditional Name: N-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxy-phenyl]carbamic acid 3-(p-tolylthio)propyl ester Formula: C27H26ClN3O5S MolecularWeight: 540.03044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCCOC(=O)NC2=C(C=C(C=C2)OC3=NC=NC4=CC(=C(C=C43)OC)OC)Cl

Isomeric SMILES

CC1=CC=C(C=C1)SCCCOC(=O)NC2=C(C=C(C=C2)OC3=NC=NC4=CC(=C(C=C43)OC)OC)Cl

InChI

InChI=1S/C27H26ClN3O5S/c1-17-5-8-19(9-6-17)37-12-4-11-35-27(32)31-22-10-7-18(13-21(22)28)36-26-20-14-24(33-2)25(34-3)15-23(20)29-16-30-26/h5-10,13-16H,4,11-12H2,1-3H3,(H,31,32)