2-(4-iodophenyl)-5-methyl-4-[[(6-methyl-1,3-benzothiazol-2-yl)amino]methylidene]pyrazol-3-one

Systemtic Name: 2-(4-iodophenyl)-5-methyl-4-[[(6-methyl-1,3-benzothiazol-2-yl)amino]methylidene]pyrazol-3-one Openeye Name: 2-(4-iodophenyl)-5-methyl-4-[[(6-methyl-1,3-benzothiazol-2-yl)amino]methylene]pyrazol-3-one CAS Name: 2-(4-iodophenyl)-5-methyl-4-[[(6-methyl-1,3-benzothiazol-2-yl)amino]methylidene]-3-pyrazolone IUPAC Name: 2-(4-iodophenyl)-5-methyl-4-[[(6-methyl-1,3-benzothiazol-2-yl)amino]methylidene]pyrazol-3-one Traditional Name: 2-(4-iodophenyl)-5-methyl-4-[[(6-methyl-1,3-benzothiazol-2-yl)amino]methylene]-2-pyrazolin-3-one Formula: C19H15IN4OS MolecularWeight: 474.31807

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC=C3C(=NN(C3=O)C4=CC=C(C=C4)I)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC=C3C(=NN(C3=O)C4=CC=C(C=C4)I)C

InChI

InChI=1S/C19H15IN4OS/c1-11-3-8-16-17(9-11)26-19(22-16)21-10-15-12(2)23-24(18(15)25)14-6-4-13(20)5-7-14/h3-10H,1-2H3,(H,21,22)