1-[1-(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)ethyl]-3-(4-nitrophenyl)-1-pentyl-urea

Systemtic Name: 1-[1-(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)ethyl]-3-(4-nitrophenyl)-1-pentyl-urea Openeye Name: 1-[1-(7-chloro-4-oxo-1H-quinazolin-2-yl)ethyl]-3-(4-nitrophenyl)-1-pentyl-urea CAS Name: 1-[1-(7-chloro-4-oxo-1H-quinazolin-2-yl)ethyl]-3-(4-nitrophenyl)-1-pentylurea IUPAC Name: 1-[1-(7-chloro-4-oxo-1H-quinazolin-2-yl)ethyl]-3-(4-nitrophenyl)-1-pentylurea Traditional Name: 1-amyl-1-[1-(7-chloro-4-keto-1H-quinazolin-2-yl)ethyl]-3-(4-nitrophenyl)urea Formula: C22H24ClN5O4 MolecularWeight: 457.91006

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C(C)C1=NC(=O)C2=C(N1)C=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCCN(C(C)C1=NC(=O)C2=C(N1)C=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H24ClN5O4/c1-3-4-5-12-27(22(30)24-16-7-9-17(10-8-16)28(31)32)14(2)20-25-19-13-15(23)6-11-18(19)21(29)26-20/h6-11,13-14H,3-5,12H2,1-2H3,(H,24,30)(H,25,26,29)