(4E)-4-[(4-iodanyl-1,6-dimethyl-indol-3-yl)methylidene]-3-(1,3-thiazol-2-yl)-1H-pyrazol-5-one

Systemtic Name: (4E)-4-[(4-iodanyl-1,6-dimethyl-indol-3-yl)methylidene]-3-(1,3-thiazol-2-yl)-1H-pyrazol-5-one Openeye Name: (4E)-4-[(4-iodo-1,6-dimethyl-indol-3-yl)methylene]-3-thiazol-2-yl-1H-pyrazol-5-one CAS Name: (4E)-4-[(4-iodo-1,6-dimethyl-3-indolyl)methylidene]-3-(2-thiazolyl)-1H-pyrazol-5-one IUPAC Name: (4E)-4-[(4-iodo-1,6-dimethylindol-3-yl)methylidene]-3-(1,3-thiazol-2-yl)-1H-pyrazol-5-one Traditional Name: (4E)-4-[(4-iodo-1,6-dimethyl-indol-3-yl)methylene]-5-thiazol-2-yl-2-pyrazolin-3-one Formula: C17H13IN4OS MolecularWeight: 448.28079

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C1)I)C(=CN2C)C=C3C(=NNC3=O)C4=NC=CS4

Isomeric SMILES

CC1=CC2=C(C(=C1)I)C(=CN2C)/C=C/3\C(=NNC3=O)C4=NC=CS4

InChI

InChI=1S/C17H13IN4OS/c1-9-5-12(18)14-10(8-22(2)13(14)6-9)7-11-15(20-21-16(11)23)17-19-3-4-24-17/h3-8H,1-2H3,(H,21,23)/b11-7+