1-(4-bromanyl-2-methyl-phenyl)-3-[[5-cyano-4-methyl-2,6-bis(oxidanylidene)pyridin-3-ylidene]methyl]urea

Systemtic Name: 1-(4-bromanyl-2-methyl-phenyl)-3-[[5-cyano-4-methyl-2,6-bis(oxidanylidene)pyridin-3-ylidene]methyl]urea Openeye Name: 1-(4-bromo-2-methyl-phenyl)-3-[(5-cyano-4-methyl-2,6-dioxo-3-pyridylidene)methyl]urea CAS Name: 1-(4-bromo-2-methylphenyl)-3-[(5-cyano-4-methyl-2,6-dioxo-3-pyridinylidene)methyl]urea IUPAC Name: 1-(4-bromo-2-methylphenyl)-3-[(5-cyano-4-methyl-2,6-dioxopyridin-3-ylidene)methyl]urea Traditional Name: 1-(4-bromo-2-methyl-phenyl)-3-[(5-cyano-2,6-diketo-4-methyl-3-pyridylidene)methyl]urea Formula: C16H13BrN4O3 MolecularWeight: 389.20342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)NC=C2C(=C(C(=O)NC2=O)C#N)C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)NC=C2C(=C(C(=O)NC2=O)C#N)C

InChI

InChI=1S/C16H13BrN4O3/c1-8-5-10(17)3-4-13(8)20-16(24)19-7-12-9(2)11(6-18)14(22)21-15(12)23/h3-5,7H,1-2H3,(H2,19,20,24)(H,21,22,23)