2-[[5-[(4-propan-2-ylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]isoindole-1,3-dione

Systemtic Name: 2-[[5-[(4-propan-2-ylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]isoindole-1,3-dione Openeye Name: 2-[[5-(4-isopropylanilino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]isoindoline-1,3-dione CAS Name: 2-[[[5-(4-propan-2-ylanilino)-1,3,4-thiadiazol-2-yl]thio]methyl]isoindole-1,3-dione IUPAC Name: 2-[[5-(4-propan-2-ylanilino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]isoindole-1,3-dione Traditional Name: 2-[[(5-cumidino-1,3,4-thiadiazol-2-yl)thio]methyl]isoindoline-1,3-quinone Formula: C20H18N4O2S2 MolecularWeight: 410.51252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC2=NN=C(S2)SCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC2=NN=C(S2)SCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C20H18N4O2S2/c1-12(2)13-7-9-14(10-8-13)21-19-22-23-20(28-19)27-11-24-17(25)15-5-3-4-6-16(15)18(24)26/h3-10,12H,11H2,1-2H3,(H,21,22)