1-(1-adamantyl)-3-[(1R)-1-(7-chloranyl-3-methyl-4-oxidanylidene-quinazolin-2-yl)ethyl]urea

Systemtic Name: 1-(1-adamantyl)-3-[(1R)-1-(7-chloranyl-3-methyl-4-oxidanylidene-quinazolin-2-yl)ethyl]urea Openeye Name: 1-(1-adamantyl)-3-[(1R)-1-(7-chloro-3-methyl-4-oxo-quinazolin-2-yl)ethyl]urea CAS Name: 1-(1-adamantyl)-3-[(1R)-1-(7-chloro-3-methyl-4-oxo-2-quinazolinyl)ethyl]urea IUPAC Name: 1-(1-adamantyl)-3-[(1R)-1-(7-chloro-3-methyl-4-oxoquinazolin-2-yl)ethyl]urea Traditional Name: 1-(1-adamantyl)-3-[(1R)-1-(7-chloro-4-keto-3-methyl-quinazolin-2-yl)ethyl]urea Formula: C22H27ClN4O2 MolecularWeight: 414.92838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=C(C=CC(=C2)Cl)C(=O)N1C)NC(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C[C@H](C1=NC2=C(C=CC(=C2)Cl)C(=O)N1C)NC(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H27ClN4O2/c1-12(19-25-18-8-16(23)3-4-17(18)20(28)27(19)2)24-21(29)26-22-9-13-5-14(10-22)7-15(6-13)11-22/h3-4,8,12-15H,5-7,9-11H2,1-2H3,(H2,24,26,29)/t12-,13?,14?,15?,22?/m1/s1