N-[2,4-bis(azanyl)quinazolin-6-yl]-3-(4-chlorophenyl)propanamide

Systemtic Name: N-[2,4-bis(azanyl)quinazolin-6-yl]-3-(4-chlorophenyl)propanamide Openeye Name: 3-(4-chlorophenyl)-N-(2,4-diaminoquinazolin-6-yl)propanamide CAS Name: 3-(4-chlorophenyl)-N-(2,4-diamino-6-quinazolinyl)propanamide IUPAC Name: 3-(4-chlorophenyl)-N-(2,4-diaminoquinazolin-6-yl)propanamide Traditional Name: 3-(4-chlorophenyl)-N-(2,4-diaminoquinazolin-6-yl)propionamide Formula: C17H16ClN5O MolecularWeight: 341.79484

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC(=O)NC2=CC3=C(C=C2)N=C(N=C3N)N)Cl

Isomeric SMILES

C1=CC(=CC=C1CCC(=O)NC2=CC3=C(C=C2)N=C(N=C3N)N)Cl

InChI

InChI=1S/C17H16ClN5O/c18-11-4-1-10(2-5-11)3-8-15(24)21-12-6-7-14-13(9-12)16(19)23-17(20)22-14/h1-2,4-7,9H,3,8H2,(H,21,24)(H4,19,20,22,23)