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

Systemtic Name: 6-(2-aminophenyl)sulfanyl-3-azanylidene-5-(4-chlorophenyl)sulfanyl-4,7-dipentoxy-isoindol-1-amine Openeye Name: 6-(2-aminophenyl)sulfanyl-5-(4-chlorophenyl)sulfanyl-3-imino-4,7-dipentoxy-isoindol-1-amine CAS Name: 6-[(2-aminophenyl)thio]-5-[(4-chlorophenyl)thio]-3-imino-4,7-dipentoxy-1-isoindolamine IUPAC Name: 6-(2-aminophenyl)sulfanyl-5-(4-chlorophenyl)sulfanyl-3-imino-4,7-dipentoxyisoindol-1-amine Traditional Name: [2-[[3-amino-4,7-diamoxy-6-[(4-chlorophenyl)thio]-1-imino-isoindol-5-yl]thio]phenyl]amine Formula: C30H35ClN4O2S2 MolecularWeight: 583.2075

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C(=C(C2=C1C(=NC2=N)N)OCCCCC)SC3=CC=C(C=C3)Cl)SC4=CC=CC=C4N

Isomeric SMILES

CCCCCOC1=C(C(=C(C2=C1C(=NC2=N)N)OCCCCC)SC3=CC=C(C=C3)Cl)SC4=CC=CC=C4N

InChI

InChI=1S/C30H35ClN4O2S2/c1-3-5-9-17-36-25-23-24(30(34)35-29(23)33)26(37-18-10-6-4-2)28(39-22-12-8-7-11-21(22)32)27(25)38-20-15-13-19(31)14-16-20/h7-8,11-16H,3-6,9-10,17-18,32H2,1-2H3,(H3,33,34,35)