5-(1,3-benzothiazol-2-yl)-2-(1-phenylethyl)isoindole-1,3-dione

Systemtic Name: 5-(1,3-benzothiazol-2-yl)-2-(1-phenylethyl)isoindole-1,3-dione Openeye Name: 5-(1,3-benzothiazol-2-yl)-2-(1-phenylethyl)isoindoline-1,3-dione CAS Name: 5-(1,3-benzothiazol-2-yl)-2-(1-phenylethyl)isoindole-1,3-dione IUPAC Name: 5-(1,3-benzothiazol-2-yl)-2-(1-phenylethyl)isoindole-1,3-dione Traditional Name: 5-(1,3-benzothiazol-2-yl)-2-(1-phenylethyl)isoindoline-1,3-quinone Formula: C23H16N2O2S MolecularWeight: 384.45034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CC(C1=CC=CC=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H16N2O2S/c1-14(15-7-3-2-4-8-15)25-22(26)17-12-11-16(13-18(17)23(25)27)21-24-19-9-5-6-10-20(19)28-21/h2-14H,1H3