3-[4-[(3-ethynylphenyl)amino]quinazolin-6-yl]-1,1-bis(2-methoxyethyl)urea

Systemtic Name: 3-[4-[(3-ethynylphenyl)amino]quinazolin-6-yl]-1,1-bis(2-methoxyethyl)urea Openeye Name: 3-[4-(3-ethynylanilino)quinazolin-6-yl]-1,1-bis(2-methoxyethyl)urea CAS Name: 3-[4-(3-ethynylanilino)-6-quinazolinyl]-1,1-bis(2-methoxyethyl)urea IUPAC Name: 3-[4-(3-ethynylanilino)quinazolin-6-yl]-1,1-bis(2-methoxyethyl)urea Traditional Name: 3-[4-(3-ethynylanilino)quinazolin-6-yl]-1,1-bis(2-methoxyethyl)urea Formula: C23H25N5O3 MolecularWeight: 419.4763

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CCOC)C(=O)NC1=CC2=C(C=C1)N=CN=C2NC3=CC=CC(=C3)C#C

Isomeric SMILES

COCCN(CCOC)C(=O)NC1=CC2=C(C=C1)N=CN=C2NC3=CC=CC(=C3)C#C

InChI

InChI=1S/C23H25N5O3/c1-4-17-6-5-7-18(14-17)26-22-20-15-19(8-9-21(20)24-16-25-22)27-23(29)28(10-12-30-2)11-13-31-3/h1,5-9,14-16H,10-13H2,2-3H3,(H,27,29)(H,24,25,26)