1-(1-adamantyl)-3-[(3-bromanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]urea

Systemtic Name: 1-(1-adamantyl)-3-[(3-bromanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]urea Openeye Name: 1-(1-adamantyl)-3-[(3-bromo-5-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]urea CAS Name: 1-(1-adamantyl)-3-[(3-bromo-5-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]urea IUPAC Name: 1-(1-adamantyl)-3-[(3-bromo-5-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]urea Traditional Name: 1-(1-adamantyl)-3-[(3-bromo-4-keto-5-methoxy-cyclohexa-2,5-dien-1-ylidene)methylamino]urea Formula: C19H24BrN3O3 MolecularWeight: 422.31616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CNNC(=O)NC23CC4CC(C2)CC(C4)C3)C=C(C1=O)Br

Isomeric SMILES

COC1=CC(=CNNC(=O)NC23CC4CC(C2)CC(C4)C3)C=C(C1=O)Br

InChI

InChI=1S/C19H24BrN3O3/c1-26-16-6-14(5-15(20)17(16)24)10-21-23-18(25)22-19-7-11-2-12(8-19)4-13(3-11)9-19/h5-6,10-13,21H,2-4,7-9H2,1H3,(H2,22,23,25)