2-methoxy-N-[3-[3-methyl-4-[(4-pyridin-4-yloxyphenyl)amino]-4H-quinazolin-6-yl]prop-2-ynyl]ethanamide

Systemtic Name: 2-methoxy-N-[3-[3-methyl-4-[(4-pyridin-4-yloxyphenyl)amino]-4H-quinazolin-6-yl]prop-2-ynyl]ethanamide Openeye Name: 2-methoxy-N-[3-[3-methyl-4-[4-(4-pyridyloxy)anilino]-4H-quinazolin-6-yl]prop-2-ynyl]acetamide CAS Name: 2-methoxy-N-[3-[3-methyl-4-(4-pyridin-4-yloxyanilino)-4H-quinazolin-6-yl]prop-2-ynyl]acetamide IUPAC Name: 2-methoxy-N-[3-[3-methyl-4-(4-pyridin-4-yloxyanilino)-4H-quinazolin-6-yl]prop-2-ynyl]acetamide Traditional Name: 2-methoxy-N-[3-[3-methyl-4-[4-(4-pyridyloxy)anilino]-4H-quinazolin-6-yl]prop-2-ynyl]acetamide Formula: C26H25N5O3 MolecularWeight: 455.5084

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C(C1NC3=CC=C(C=C3)OC4=CC=NC=C4)C=C(C=C2)C#CCNC(=O)COC

Isomeric SMILES

CN1C=NC2=C(C1NC3=CC=C(C=C3)OC4=CC=NC=C4)C=C(C=C2)C#CCNC(=O)COC

InChI

InChI=1S/C26H25N5O3/c1-31-18-29-24-10-5-19(4-3-13-28-25(32)17-33-2)16-23(24)26(31)30-20-6-8-21(9-7-20)34-22-11-14-27-15-12-22/h5-12,14-16,18,26,30H,13,17H2,1-2H3,(H,28,32)