4-azanyl-2-[[methyl-[(4-methylsulfanylphenyl)methyl]amino]methyl]isoindole-1,3-dione

Systemtic Name: 4-azanyl-2-[[methyl-[(4-methylsulfanylphenyl)methyl]amino]methyl]isoindole-1,3-dione Openeye Name: 4-amino-2-[[methyl-[(4-methylsulfanylphenyl)methyl]amino]methyl]isoindoline-1,3-dione CAS Name: 4-amino-2-[[methyl-[[4-(methylthio)phenyl]methyl]amino]methyl]isoindole-1,3-dione IUPAC Name: 4-amino-2-[[methyl-[(4-methylsulfanylphenyl)methyl]amino]methyl]isoindole-1,3-dione Traditional Name: 4-amino-2-[[methyl-[4-(methylthio)benzyl]amino]methyl]isoindoline-1,3-quinone Formula: C18H19N3O2S MolecularWeight: 341.42736

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)SC)CN2C(=O)C3=C(C2=O)C(=CC=C3)N

Isomeric SMILES

CN(CC1=CC=C(C=C1)SC)CN2C(=O)C3=C(C2=O)C(=CC=C3)N

InChI

InChI=1S/C18H19N3O2S/c1-20(10-12-6-8-13(24-2)9-7-12)11-21-17(22)14-4-3-5-15(19)16(14)18(21)23/h3-9H,10-11,19H2,1-2H3