1-(6-azanylhexyl)-1-[1-(7-chloranyl-3-methyl-4-oxidanylidene-quinazolin-2-yl)ethyl]-3-(4-nitrophenyl)urea

Systemtic Name: 1-(6-azanylhexyl)-1-[1-(7-chloranyl-3-methyl-4-oxidanylidene-quinazolin-2-yl)ethyl]-3-(4-nitrophenyl)urea Openeye Name: 1-(6-aminohexyl)-1-[1-(7-chloro-3-methyl-4-oxo-quinazolin-2-yl)ethyl]-3-(4-nitrophenyl)urea CAS Name: 1-(6-aminohexyl)-1-[1-(7-chloro-3-methyl-4-oxo-2-quinazolinyl)ethyl]-3-(4-nitrophenyl)urea IUPAC Name: 1-(6-aminohexyl)-1-[1-(7-chloro-3-methyl-4-oxoquinazolin-2-yl)ethyl]-3-(4-nitrophenyl)urea Traditional Name: 1-(6-aminohexyl)-1-[1-(7-chloro-4-keto-3-methyl-quinazolin-2-yl)ethyl]-3-(4-nitrophenyl)urea Formula: C24H29ClN6O4 MolecularWeight: 500.97786

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=C(C=CC(=C2)Cl)C(=O)N1C)N(CCCCCCN)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C1=NC2=C(C=CC(=C2)Cl)C(=O)N1C)N(CCCCCCN)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C24H29ClN6O4/c1-16(22-28-21-15-17(25)7-12-20(21)23(32)29(22)2)30(14-6-4-3-5-13-26)24(33)27-18-8-10-19(11-9-18)31(34)35/h7-12,15-16H,3-6,13-14,26H2,1-2H3,(H,27,33)