1-[[3-bromanyl-4-[(4-iodophenyl)methoxy]-5-methoxy-phenyl]methylideneamino]-3-(2-methylphenyl)urea

Systemtic Name: 1-[[3-bromanyl-4-[(4-iodophenyl)methoxy]-5-methoxy-phenyl]methylideneamino]-3-(2-methylphenyl)urea Openeye Name: 1-[[3-bromo-4-[(4-iodophenyl)methoxy]-5-methoxy-phenyl]methyleneamino]-3-(o-tolyl)urea CAS Name: 1-[[3-bromo-4-[(4-iodophenyl)methoxy]-5-methoxyphenyl]methylideneamino]-3-(2-methylphenyl)urea IUPAC Name: 1-[[3-bromo-4-[(4-iodophenyl)methoxy]-5-methoxyphenyl]methylideneamino]-3-(2-methylphenyl)urea Traditional Name: 1-[[3-bromo-4-(4-iodobenzyl)oxy-5-methoxy-benzylidene]amino]-3-(o-tolyl)urea Formula: C23H21BrIN3O3 MolecularWeight: 594.23961

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)NN=CC2=CC(=C(C(=C2)Br)OCC3=CC=C(C=C3)I)OC

Isomeric SMILES

CC1=CC=CC=C1NC(=O)NN=CC2=CC(=C(C(=C2)Br)OCC3=CC=C(C=C3)I)OC

InChI

InChI=1S/C23H21BrIN3O3/c1-15-5-3-4-6-20(15)27-23(29)28-26-13-17-11-19(24)22(21(12-17)30-2)31-14-16-7-9-18(25)10-8-16/h3-13H,14H2,1-2H3,(H2,27,28,29)