2-[[(2E)-2-indol-3-ylidene-3H-1,3-thiazol-4-yl]methyl]isoindole-1,3-dione hydrochloride

Systemtic Name: 2-[[(2E)-2-indol-3-ylidene-3H-1,3-thiazol-4-yl]methyl]isoindole-1,3-dione hydrochloride Openeye Name: 2-[[(2E)-2-indol-3-ylidene-3H-thiazol-4-yl]methyl]isoindoline-1,3-dione hydrochloride CAS Name: 2-[[(2E)-2-(3-indolylidene)-3H-thiazol-4-yl]methyl]isoindole-1,3-dione hydrochloride IUPAC Name: 2-[[(2E)-2-indol-3-ylidene-3H-1,3-thiazol-4-yl]methyl]isoindole-1,3-dione hydrochloride Traditional Name: 2-[[(2E)-2-indol-3-ylidene-4-thiazolin-4-yl]methyl]isoindoline-1,3-quinone hydrochloride Formula: C20H14ClN3O2S MolecularWeight: 395.86206

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CC3=CSC(=C4C=NC5=CC=CC=C54)N3.Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CC3=CS/C(=C\4/C=NC5=CC=CC=C54)/N3.Cl

InChI

InChI=1S/C20H13N3O2S.ClH/c24-19-14-6-1-2-7-15(14)20(25)23(19)10-12-11-26-18(22-12)16-9-21-17-8-4-3-5-13(16)17;/h1-9,11,22H,10H2;1H/b18-16-;