1-(2-diethylaminoethyl)-3-[4-[(3-ethynylphenyl)amino]quinazolin-7-yl]-1-methyl-urea

Systemtic Name: 1-(2-diethylaminoethyl)-3-[4-[(3-ethynylphenyl)amino]quinazolin-7-yl]-1-methyl-urea Openeye Name: 1-(2-diethylaminoethyl)-3-[4-(3-ethynylanilino)quinazolin-7-yl]-1-methyl-urea CAS Name: 1-(2-diethylaminoethyl)-3-[4-(3-ethynylanilino)-7-quinazolinyl]-1-methylurea IUPAC Name: 1-(2-diethylaminoethyl)-3-[4-(3-ethynylanilino)quinazolin-7-yl]-1-methylurea Traditional Name: 1-(2-diethylaminoethyl)-3-[4-(3-ethynylanilino)quinazolin-7-yl]-1-methyl-urea Formula: C24H28N6O MolecularWeight: 416.51872

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C)C(=O)NC1=CC2=C(C=C1)C(=NC=N2)NC3=CC=CC(=C3)C#C

Isomeric SMILES

CCN(CC)CCN(C)C(=O)NC1=CC2=C(C=C1)C(=NC=N2)NC3=CC=CC(=C3)C#C

InChI

InChI=1S/C24H28N6O/c1-5-18-9-8-10-19(15-18)27-23-21-12-11-20(16-22(21)25-17-26-23)28-24(31)29(4)13-14-30(6-2)7-3/h1,8-12,15-17H,6-7,13-14H2,2-4H3,(H,28,31)(H,25,26,27)