1-(cyclopropylmethyl)-3-[4-[(3-ethynylphenyl)amino]quinazolin-6-yl]-1-propyl-urea

Systemtic Name: 1-(cyclopropylmethyl)-3-[4-[(3-ethynylphenyl)amino]quinazolin-6-yl]-1-propyl-urea Openeye Name: 1-(cyclopropylmethyl)-3-[4-(3-ethynylanilino)quinazolin-6-yl]-1-propyl-urea CAS Name: 1-(cyclopropylmethyl)-3-[4-(3-ethynylanilino)-6-quinazolinyl]-1-propylurea IUPAC Name: 1-(cyclopropylmethyl)-3-[4-(3-ethynylanilino)quinazolin-6-yl]-1-propylurea Traditional Name: 1-(cyclopropylmethyl)-3-[4-(3-ethynylanilino)quinazolin-6-yl]-1-propyl-urea Formula: C24H25N5O MolecularWeight: 399.4882

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1CC1)C(=O)NC2=CC3=C(C=C2)N=CN=C3NC4=CC=CC(=C4)C#C

Isomeric SMILES

CCCN(CC1CC1)C(=O)NC2=CC3=C(C=C2)N=CN=C3NC4=CC=CC(=C4)C#C

InChI

InChI=1S/C24H25N5O/c1-3-12-29(15-18-8-9-18)24(30)28-20-10-11-22-21(14-20)23(26-16-25-22)27-19-7-5-6-17(4-2)13-19/h2,5-7,10-11,13-14,16,18H,3,8-9,12,15H2,1H3,(H,28,30)(H,25,26,27)