3-[(7-chloranyl-2-ethyl-quinazolin-4-yl)-(furan-2-ylmethyl)amino]-N-(2-methylpropyl)propanamide

Systemtic Name: 3-[(7-chloranyl-2-ethyl-quinazolin-4-yl)-(furan-2-ylmethyl)amino]-N-(2-methylpropyl)propanamide Openeye Name: 3-[(7-chloro-2-ethyl-quinazolin-4-yl)-(2-furylmethyl)amino]-N-isobutyl-propanamide CAS Name: 3-[(7-chloro-2-ethyl-4-quinazolinyl)-(2-furanylmethyl)amino]-N-(2-methylpropyl)propanamide IUPAC Name: 3-[(7-chloro-2-ethylquinazolin-4-yl)-(furan-2-ylmethyl)amino]-N-(2-methylpropyl)propanamide Traditional Name: 3-[(7-chloro-2-ethyl-quinazolin-4-yl)-(2-furfuryl)amino]-N-isobutyl-propionamide Formula: C22H27ClN4O2 MolecularWeight: 414.92838

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=CC(=C2)Cl)C(=N1)N(CCC(=O)NCC(C)C)CC3=CC=CO3

Isomeric SMILES

CCC1=NC2=C(C=CC(=C2)Cl)C(=N1)N(CCC(=O)NCC(C)C)CC3=CC=CO3

InChI

InChI=1S/C22H27ClN4O2/c1-4-20-25-19-12-16(23)7-8-18(19)22(26-20)27(14-17-6-5-11-29-17)10-9-21(28)24-13-15(2)3/h5-8,11-12,15H,4,9-10,13-14H2,1-3H3,(H,24,28)