2-(1,3-benzothiazol-2-yl)-5-butyl-4-methyl-1H-pyrazolo[4,3-c]pyridine-3,6-dione

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-5-butyl-4-methyl-1H-pyrazolo[4,3-c]pyridine-3,6-dione Openeye Name: 2-(1,3-benzothiazol-2-yl)-5-butyl-4-methyl-1H-pyrazolo[4,3-c]pyridine-3,6-dione CAS Name: 2-(1,3-benzothiazol-2-yl)-5-butyl-4-methyl-1H-pyrazolo[4,3-c]pyridine-3,6-dione IUPAC Name: 2-(1,3-benzothiazol-2-yl)-5-butyl-4-methyl-1H-pyrazolo[4,3-c]pyridine-3,6-dione Traditional Name: 2-(1,3-benzothiazol-2-yl)-5-butyl-4-methyl-1H-pyrazolo[4,3-c]pyridine-3,6-quinone Formula: C18H18N4O2S MolecularWeight: 354.42612

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C2C(=CC1=O)NN(C2=O)C3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CCCCN1C(=C2C(=CC1=O)NN(C2=O)C3=NC4=CC=CC=C4S3)C

InChI

InChI=1S/C18H18N4O2S/c1-3-4-9-21-11(2)16-13(10-15(21)23)20-22(17(16)24)18-19-12-7-5-6-8-14(12)25-18/h5-8,10,20H,3-4,9H2,1-2H3