[5-[[6-methoxy-7-(thiophen-3-ylmethoxy)quinazolin-4-yl]amino]-2-methyl-phenyl] ethanoate

Systemtic Name: [5-[[6-methoxy-7-(thiophen-3-ylmethoxy)quinazolin-4-yl]amino]-2-methyl-phenyl] ethanoate Openeye Name: [5-[[6-methoxy-7-(3-thienylmethoxy)quinazolin-4-yl]amino]-2-methyl-phenyl] acetate CAS Name: acetic acid [5-[[6-methoxy-7-(3-thiophenylmethoxy)-4-quinazolinyl]amino]-2-methylphenyl] ester IUPAC Name: [5-[[6-methoxy-7-(thiophen-3-ylmethoxy)quinazolin-4-yl]amino]-2-methylphenyl] acetate Traditional Name: acetic acid [5-[[6-methoxy-7-(3-thenyloxy)quinazolin-4-yl]amino]-2-methyl-phenyl] ester Formula: C23H21N3O4S MolecularWeight: 435.49554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NC=NC3=CC(=C(C=C32)OC)OCC4=CSC=C4)OC(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NC=NC3=CC(=C(C=C32)OC)OCC4=CSC=C4)OC(=O)C

InChI

InChI=1S/C23H21N3O4S/c1-14-4-5-17(8-20(14)30-15(2)27)26-23-18-9-21(28-3)22(10-19(18)24-13-25-23)29-11-16-6-7-31-12-16/h4-10,12-13H,11H2,1-3H3,(H,24,25,26)