N-[4-[[3-chloranyl-4-(thiophen-3-ylmethoxy)phenyl]amino]quinazolin-6-yl]-7-morpholin-4-yl-hept-2-ynamide

Systemtic Name: N-[4-[[3-chloranyl-4-(thiophen-3-ylmethoxy)phenyl]amino]quinazolin-6-yl]-7-morpholin-4-yl-hept-2-ynamide Openeye Name: N-[4-[3-chloro-4-(3-thienylmethoxy)anilino]quinazolin-6-yl]-7-morpholino-hept-2-ynamide CAS Name: N-[4-[3-chloro-4-(3-thiophenylmethoxy)anilino]-6-quinazolinyl]-7-(4-morpholinyl)-2-heptynamide IUPAC Name: N-[4-[3-chloro-4-(thiophen-3-ylmethoxy)anilino]quinazolin-6-yl]-7-morpholin-4-ylhept-2-ynamide Traditional Name: N-[4-[3-chloro-4-(3-thenyloxy)anilino]quinazolin-6-yl]-7-morpholino-hept-2-ynamide Formula: C30H30ClN5O3S MolecularWeight: 576.1089

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCCC#CC(=O)NC2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)OCC5=CSC=C5)Cl

Isomeric SMILES

C1COCCN1CCCCC#CC(=O)NC2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)OCC5=CSC=C5)Cl

InChI

InChI=1S/C30H30ClN5O3S/c31-26-18-24(7-9-28(26)39-19-22-10-16-40-20-22)35-30-25-17-23(6-8-27(25)32-21-33-30)34-29(37)5-3-1-2-4-11-36-12-14-38-15-13-36/h6-10,16-18,20-21H,1-2,4,11-15,19H2,(H,34,37)(H,32,33,35)