[4-[3-[(6-chloranylquinazolin-4-yl)amino]-2-oxidanylidene-pyrrolidin-1-yl]-3-propyl-cyclohexyl]carbamic acid

Systemtic Name: [4-[3-[(6-chloranylquinazolin-4-yl)amino]-2-oxidanylidene-pyrrolidin-1-yl]-3-propyl-cyclohexyl]carbamic acid Openeye Name: [4-[3-[(6-chloroquinazolin-4-yl)amino]-2-oxo-pyrrolidin-1-yl]-3-propyl-cyclohexyl]carbamic acid CAS Name: [4-[3-[(6-chloro-4-quinazolinyl)amino]-2-oxo-1-pyrrolidinyl]-3-propylcyclohexyl]carbamic acid IUPAC Name: [4-[3-[(6-chloroquinazolin-4-yl)amino]-2-oxopyrrolidin-1-yl]-3-propylcyclohexyl]carbamic acid Traditional Name: [4-[3-[(6-chloroquinazolin-4-yl)amino]-2-keto-pyrrolidino]-3-propyl-cyclohexyl]carbamic acid Formula: C22H28ClN5O3 MolecularWeight: 445.94242

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CC(CCC1N2CCC(C2=O)NC3=NC=NC4=C3C=C(C=C4)Cl)NC(=O)O

Isomeric SMILES

CCCC1CC(CCC1N2CCC(C2=O)NC3=NC=NC4=C3C=C(C=C4)Cl)NC(=O)O

InChI

InChI=1S/C22H28ClN5O3/c1-2-3-13-10-15(26-22(30)31)5-7-19(13)28-9-8-18(21(28)29)27-20-16-11-14(23)4-6-17(16)24-12-25-20/h4,6,11-13,15,18-19,26H,2-3,5,7-10H2,1H3,(H,30,31)(H,24,25,27)