4-[[(5-butyl-1,3,4-thiadiazol-2-yl)amino]methylidene]-2-(4-methylphenyl)isoquinoline-1,3-dione

Systemtic Name: 4-[[(5-butyl-1,3,4-thiadiazol-2-yl)amino]methylidene]-2-(4-methylphenyl)isoquinoline-1,3-dione Openeye Name: 4-[[(5-butyl-1,3,4-thiadiazol-2-yl)amino]methylene]-2-(p-tolyl)isoquinoline-1,3-dione CAS Name: 4-[[(5-butyl-1,3,4-thiadiazol-2-yl)amino]methylidene]-2-(4-methylphenyl)isoquinoline-1,3-dione IUPAC Name: 4-[[(5-butyl-1,3,4-thiadiazol-2-yl)amino]methylidene]-2-(4-methylphenyl)isoquinoline-1,3-dione Traditional Name: 4-[[(5-butyl-1,3,4-thiadiazol-2-yl)amino]methylene]-2-(p-tolyl)isoquinoline-1,3-quinone Formula: C23H22N4O2S MolecularWeight: 418.51138

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN=C(S1)NC=C2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCCCC1=NN=C(S1)NC=C2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C23H22N4O2S/c1-3-4-9-20-25-26-23(30-20)24-14-19-17-7-5-6-8-18(17)21(28)27(22(19)29)16-12-10-15(2)11-13-16/h5-8,10-14H,3-4,9H2,1-2H3,(H,24,26)