6-(2-aminophenyl)sulfanyl-3-azanylidene-5-chloranyl-4,7-diethoxy-isoindol-1-amine

Systemtic Name: 6-(2-aminophenyl)sulfanyl-3-azanylidene-5-chloranyl-4,7-diethoxy-isoindol-1-amine Openeye Name: 6-(2-aminophenyl)sulfanyl-5-chloro-4,7-diethoxy-3-imino-isoindol-1-amine CAS Name: 6-[(2-aminophenyl)thio]-5-chloro-4,7-diethoxy-3-imino-1-isoindolamine IUPAC Name: 6-(2-aminophenyl)sulfanyl-5-chloro-4,7-diethoxy-3-iminoisoindol-1-amine Traditional Name: [2-[(3-amino-6-chloro-4,7-diethoxy-1-imino-isoindol-5-yl)thio]phenyl]amine Formula: C18H19ClN4O2S MolecularWeight: 390.88706

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=C(C2=C1C(=NC2=N)N)OCC)Cl)SC3=CC=CC=C3N

Isomeric SMILES

CCOC1=C(C(=C(C2=C1C(=NC2=N)N)OCC)Cl)SC3=CC=CC=C3N

InChI

InChI=1S/C18H19ClN4O2S/c1-3-24-14-11-12(18(22)23-17(11)21)15(25-4-2)16(13(14)19)26-10-8-6-5-7-9(10)20/h5-8H,3-4,20H2,1-2H3,(H3,21,22,23)