5-(2-aminophenyl)sulfanyl-3-azanylidene-6-pentylsulfanyl-4,7-di(propan-2-yloxy)isoindol-1-amine

Systemtic Name: 5-(2-aminophenyl)sulfanyl-3-azanylidene-6-pentylsulfanyl-4,7-di(propan-2-yloxy)isoindol-1-amine Openeye Name: 5-(2-aminophenyl)sulfanyl-3-imino-4,7-diisopropoxy-6-pentylsulfanyl-isoindol-1-amine CAS Name: 5-[(2-aminophenyl)thio]-3-imino-6-(pentylthio)-4,7-di(propan-2-yloxy)-1-isoindolamine IUPAC Name: 5-(2-aminophenyl)sulfanyl-3-imino-6-pentylsulfanyl-4,7-di(propan-2-yloxy)isoindol-1-amine Traditional Name: [2-[[1-amino-6-(amylthio)-3-imino-4,7-diisopropoxy-isoindol-5-yl]thio]phenyl]amine Formula: C25H34N4O2S2 MolecularWeight: 486.69306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1=C(C2=C(C(=C1SC3=CC=CC=C3N)OC(C)C)C(=N)N=C2N)OC(C)C

Isomeric SMILES

CCCCCSC1=C(C2=C(C(=C1SC3=CC=CC=C3N)OC(C)C)C(=N)N=C2N)OC(C)C

InChI

InChI=1S/C25H34N4O2S2/c1-6-7-10-13-32-22-20(30-14(2)3)18-19(25(28)29-24(18)27)21(31-15(4)5)23(22)33-17-12-9-8-11-16(17)26/h8-9,11-12,14-15H,6-7,10,13,26H2,1-5H3,(H3,27,28,29)