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

Systemtic Name: 2-(4-bromophenyl)-4-[[(6-methoxy-1,3-benzothiazol-2-yl)amino]methylidene]-5-methyl-pyrazol-3-one Openeye Name: 2-(4-bromophenyl)-4-[[(6-methoxy-1,3-benzothiazol-2-yl)amino]methylene]-5-methyl-pyrazol-3-one CAS Name: 2-(4-bromophenyl)-4-[[(6-methoxy-1,3-benzothiazol-2-yl)amino]methylidene]-5-methyl-3-pyrazolone IUPAC Name: 2-(4-bromophenyl)-4-[[(6-methoxy-1,3-benzothiazol-2-yl)amino]methylidene]-5-methylpyrazol-3-one Traditional Name: 2-(4-bromophenyl)-4-[[(6-methoxy-1,3-benzothiazol-2-yl)amino]methylene]-5-methyl-2-pyrazolin-3-one Formula: C19H15BrN4O2S MolecularWeight: 443.317

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CNC2=NC3=C(S2)C=C(C=C3)OC)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=NN(C(=O)C1=CNC2=NC3=C(S2)C=C(C=C3)OC)C4=CC=C(C=C4)Br

InChI

InChI=1S/C19H15BrN4O2S/c1-11-15(18(25)24(23-11)13-5-3-12(20)4-6-13)10-21-19-22-16-8-7-14(26-2)9-17(16)27-19/h3-10H,1-2H3,(H,21,22)