1,1-bis(3-bromanyl-5-isocyanato-4-methyl-phenyl)urea

Systemtic Name: 1,1-bis(3-bromanyl-5-isocyanato-4-methyl-phenyl)urea Openeye Name: 1,1-bis(3-bromo-5-isocyanato-4-methyl-phenyl)urea CAS Name: 1,1-bis(3-bromo-5-isocyanato-4-methylphenyl)urea IUPAC Name: 1,1-bis(3-bromo-5-isocyanato-4-methylphenyl)urea Traditional Name: 1,1-bis(3-bromo-5-isocyanato-4-methyl-phenyl)urea Formula: C17H12Br2N4O3 MolecularWeight: 480.11018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1N=C=O)N(C2=CC(=C(C(=C2)N=C=O)C)Br)C(=O)N)Br

Isomeric SMILES

CC1=C(C=C(C=C1N=C=O)N(C2=CC(=C(C(=C2)N=C=O)C)Br)C(=O)N)Br

InChI

InChI=1S/C17H12Br2N4O3/c1-9-13(18)3-11(5-15(9)21-7-24)23(17(20)26)12-4-14(19)10(2)16(6-12)22-8-25/h3-6H,1-2H3,(H2,20,26)