(2R)-N-(4-acetamido-3-chloranyl-phenyl)-1-quinazolin-4-yl-pyrrolidine-2-carboxamide

Systemtic Name: (2R)-N-(4-acetamido-3-chloranyl-phenyl)-1-quinazolin-4-yl-pyrrolidine-2-carboxamide Openeye Name: (2R)-N-(4-acetamido-3-chloro-phenyl)-1-quinazolin-4-yl-pyrrolidine-2-carboxamide CAS Name: (2R)-N-(4-acetamido-3-chlorophenyl)-1-(4-quinazolinyl)-2-pyrrolidinecarboxamide IUPAC Name: (2R)-N-(4-acetamido-3-chlorophenyl)-1-quinazolin-4-ylpyrrolidine-2-carboxamide Traditional Name: (2R)-N-(4-acetamido-3-chloro-phenyl)-1-quinazolin-4-yl-pyrrolidine-2-carboxamide Formula: C21H20ClN5O2 MolecularWeight: 409.8688

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)NC(=O)C2CCCN2C3=NC=NC4=CC=CC=C43)Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)NC(=O)[C@H]2CCCN2C3=NC=NC4=CC=CC=C43)Cl

InChI

InChI=1S/C21H20ClN5O2/c1-13(28)25-18-9-8-14(11-16(18)22)26-21(29)19-7-4-10-27(19)20-15-5-2-3-6-17(15)23-12-24-20/h2-3,5-6,8-9,11-12,19H,4,7,10H2,1H3,(H,25,28)(H,26,29)/t19-/m1/s1