1-[2-chloranyl-4-[6-methoxy-7-(3-pyridin-4-ylsulfanylpropoxy)quinazolin-4-yl]oxy-phenyl]-3-propyl-urea

Systemtic Name: 1-[2-chloranyl-4-[6-methoxy-7-(3-pyridin-4-ylsulfanylpropoxy)quinazolin-4-yl]oxy-phenyl]-3-propyl-urea Openeye Name: 1-[2-chloro-4-[6-methoxy-7-[3-(4-pyridylsulfanyl)propoxy]quinazolin-4-yl]oxy-phenyl]-3-propyl-urea CAS Name: 1-[2-chloro-4-[[6-methoxy-7-[3-(pyridin-4-ylthio)propoxy]-4-quinazolinyl]oxy]phenyl]-3-propylurea IUPAC Name: 1-[2-chloro-4-[6-methoxy-7-(3-pyridin-4-ylsulfanylpropoxy)quinazolin-4-yl]oxyphenyl]-3-propylurea Traditional Name: 1-[2-chloro-4-[6-methoxy-7-[3-(4-pyridylthio)propoxy]quinazolin-4-yl]oxy-phenyl]-3-propyl-urea Formula: C27H28ClN5O4S MolecularWeight: 554.06032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC1=C(C=C(C=C1)OC2=NC=NC3=CC(=C(C=C32)OC)OCCCSC4=CC=NC=C4)Cl

Isomeric SMILES

CCCNC(=O)NC1=C(C=C(C=C1)OC2=NC=NC3=CC(=C(C=C32)OC)OCCCSC4=CC=NC=C4)Cl

InChI

InChI=1S/C27H28ClN5O4S/c1-3-9-30-27(34)33-22-6-5-18(14-21(22)28)37-26-20-15-24(35-2)25(16-23(20)31-17-32-26)36-12-4-13-38-19-7-10-29-11-8-19/h5-8,10-11,14-17H,3-4,9,12-13H2,1-2H3,(H2,30,33,34)