2-[[7-chloranyl-4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]-(2-methylpropyl)amino]ethylcarbamic acid

Systemtic Name: 2-[[7-chloranyl-4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]-(2-methylpropyl)amino]ethylcarbamic acid Openeye Name: 2-[(3-benzyl-7-chloro-4-oxo-quinazolin-2-yl)-isobutyl-amino]ethylcarbamic acid CAS Name: 2-[[7-chloro-4-oxo-3-(phenylmethyl)-2-quinazolinyl]-(2-methylpropyl)amino]ethylcarbamic acid IUPAC Name: 2-[(3-benzyl-7-chloro-4-oxoquinazolin-2-yl)-(2-methylpropyl)amino]ethylcarbamic acid Traditional Name: 2-[(3-benzyl-7-chloro-4-keto-quinazolin-2-yl)-isobutyl-amino]ethylcarbamic acid Formula: C22H25ClN4O3 MolecularWeight: 428.9119

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CCNC(=O)O)C1=NC2=C(C=CC(=C2)Cl)C(=O)N1CC3=CC=CC=C3

Isomeric SMILES

CC(C)CN(CCNC(=O)O)C1=NC2=C(C=CC(=C2)Cl)C(=O)N1CC3=CC=CC=C3

InChI

InChI=1S/C22H25ClN4O3/c1-15(2)13-26(11-10-24-22(29)30)21-25-19-12-17(23)8-9-18(19)20(28)27(21)14-16-6-4-3-5-7-16/h3-9,12,15,24H,10-11,13-14H2,1-2H3,(H,29,30)