1-[(E)-[1-(4-iodophenyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]methyl]-3-naphthalen-1-yl-urea

Systemtic Name: 1-[(E)-[1-(4-iodophenyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]methyl]-3-naphthalen-1-yl-urea Openeye Name: 1-[(E)-[1-(4-iodophenyl)-3-methyl-5-oxo-pyrazol-4-ylidene]methyl]-3-(1-naphthyl)urea CAS Name: 1-[(E)-[1-(4-iodophenyl)-3-methyl-5-oxo-4-pyrazolylidene]methyl]-3-(1-naphthalenyl)urea IUPAC Name: 1-[(E)-[1-(4-iodophenyl)-3-methyl-5-oxopyrazol-4-ylidene]methyl]-3-naphthalen-1-ylurea Traditional Name: 1-[(E)-[1-(4-iodophenyl)-5-keto-3-methyl-2-pyrazolin-4-ylidene]methyl]-3-(1-naphthyl)urea Formula: C22H17IN4O2 MolecularWeight: 496.30045

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CNC(=O)NC2=CC=CC3=CC=CC=C32)C4=CC=C(C=C4)I

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/NC(=O)NC2=CC=CC3=CC=CC=C32)C4=CC=C(C=C4)I

InChI

InChI=1S/C22H17IN4O2/c1-14-19(21(28)27(26-14)17-11-9-16(23)10-12-17)13-24-22(29)25-20-8-4-6-15-5-2-3-7-18(15)20/h2-13H,1H3,(H2,24,25,29)/b19-13+