1-[4-[(3-ethynylphenyl)amino]quinazolin-6-yl]-3-(2-pyrrolidin-1-ylethyl)urea

Systemtic Name: 1-[4-[(3-ethynylphenyl)amino]quinazolin-6-yl]-3-(2-pyrrolidin-1-ylethyl)urea Openeye Name: 1-[4-(3-ethynylanilino)quinazolin-6-yl]-3-(2-pyrrolidin-1-ylethyl)urea CAS Name: 1-[4-(3-ethynylanilino)-6-quinazolinyl]-3-[2-(1-pyrrolidinyl)ethyl]urea IUPAC Name: 1-[4-(3-ethynylanilino)quinazolin-6-yl]-3-(2-pyrrolidin-1-ylethyl)urea Traditional Name: 1-[4-(3-ethynylanilino)quinazolin-6-yl]-3-(2-pyrrolidinoethyl)urea Formula: C23H24N6O MolecularWeight: 400.47626

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC2=NC=NC3=C2C=C(C=C3)NC(=O)NCCN4CCCC4

Isomeric SMILES

C#CC1=CC(=CC=C1)NC2=NC=NC3=C2C=C(C=C3)NC(=O)NCCN4CCCC4

InChI

InChI=1S/C23H24N6O/c1-2-17-6-5-7-18(14-17)27-22-20-15-19(8-9-21(20)25-16-26-22)28-23(30)24-10-13-29-11-3-4-12-29/h1,5-9,14-16H,3-4,10-13H2,(H2,24,28,30)(H,25,26,27)