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

Systemtic Name: 5-(1,3-benzothiazol-2-yl)-2-propyl-isoindole-1,3-dione Openeye Name: 5-(1,3-benzothiazol-2-yl)-2-propyl-isoindoline-1,3-dione CAS Name: 5-(1,3-benzothiazol-2-yl)-2-propylisoindole-1,3-dione IUPAC Name: 5-(1,3-benzothiazol-2-yl)-2-propylisoindole-1,3-dione Traditional Name: 5-(1,3-benzothiazol-2-yl)-2-propyl-isoindoline-1,3-quinone Formula: C18H14N2O2S MolecularWeight: 322.38096

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(C1=O)C=C(C=C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCCN1C(=O)C2=C(C1=O)C=C(C=C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H14N2O2S/c1-2-9-20-17(21)12-8-7-11(10-13(12)18(20)22)16-19-14-5-3-4-6-15(14)23-16/h3-8,10H,2,9H2,1H3