1-(1-adamantylcarbonyl)-N-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-ethyl-pyrrolidine-2-carboxamide

Systemtic Name: 1-(1-adamantylcarbonyl)-N-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-ethyl-pyrrolidine-2-carboxamide Openeye Name: 1-(adamantane-1-carbonyl)-N-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-N-ethyl-pyrrolidine-2-carboxamide CAS Name: 1-[1-adamantyl(oxo)methyl]-N-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-N-ethyl-2-pyrrolidinecarboxamide IUPAC Name: 1-(adamantane-1-carbonyl)-N-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-N-ethylpyrrolidine-2-carboxamide Traditional Name: 1-(adamantane-1-carbonyl)-N-[(7-chloro-4-keto-1H-quinazolin-2-yl)methyl]-N-ethyl-pyrrolidine-2-carboxamide Formula: C27H33ClN4O3 MolecularWeight: 497.02892

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)C(=O)C3CCCN3C(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)C(=O)C3CCCN3C(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C27H33ClN4O3/c1-2-31(15-23-29-21-11-19(28)5-6-20(21)24(33)30-23)25(34)22-4-3-7-32(22)26(35)27-12-16-8-17(13-27)10-18(9-16)14-27/h5-6,11,16-18,22H,2-4,7-10,12-15H2,1H3,(H,29,30,33)