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

Systemtic Name: 4-[[(6-ethoxy-1,3-benzothiazol-2-yl)amino]methylidene]-5-methyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[[(6-ethoxy-1,3-benzothiazol-2-yl)amino]methylene]-5-methyl-2-phenyl-pyrazol-3-one CAS Name: 4-[[(6-ethoxy-1,3-benzothiazol-2-yl)amino]methylidene]-5-methyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[[(6-ethoxy-1,3-benzothiazol-2-yl)amino]methylidene]-5-methyl-2-phenylpyrazol-3-one Traditional Name: 4-[[(6-ethoxy-1,3-benzothiazol-2-yl)amino]methylene]-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C20H18N4O2S MolecularWeight: 378.44752

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC=C3C(=NN(C3=O)C4=CC=CC=C4)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC=C3C(=NN(C3=O)C4=CC=CC=C4)C

InChI

InChI=1S/C20H18N4O2S/c1-3-26-15-9-10-17-18(11-15)27-20(22-17)21-12-16-13(2)23-24(19(16)25)14-7-5-4-6-8-14/h4-12H,3H2,1-2H3,(H,21,22)