6-(2-aminophenyl)sulfanyl-3-azanylidene-4,7-dibutoxy-5-[4-(dibutylamino)phenyl]sulfanyl-isoindol-1-amine

Systemtic Name: 6-(2-aminophenyl)sulfanyl-3-azanylidene-4,7-dibutoxy-5-[4-(dibutylamino)phenyl]sulfanyl-isoindol-1-amine Openeye Name: 6-(2-aminophenyl)sulfanyl-4,7-dibutoxy-5-[4-(dibutylamino)phenyl]sulfanyl-3-imino-isoindol-1-amine CAS Name: 6-[(2-aminophenyl)thio]-4,7-dibutoxy-5-[[4-(dibutylamino)phenyl]thio]-3-imino-1-isoindolamine IUPAC Name: 6-(2-aminophenyl)sulfanyl-4,7-dibutoxy-5-[4-(dibutylamino)phenyl]sulfanyl-3-iminoisoindol-1-amine Traditional Name: [4-[[1-amino-6-[(2-aminophenyl)thio]-4,7-dibutoxy-3-imino-isoindol-5-yl]thio]phenyl]-dibutyl-amine Formula: C36H49N5O2S2 MolecularWeight: 647.93656

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C1=CC=C(C=C1)SC2=C(C3=C(C(=C2SC4=CC=CC=C4N)OCCCC)C(=NC3=N)N)OCCCC

Isomeric SMILES

CCCCN(CCCC)C1=CC=C(C=C1)SC2=C(C3=C(C(=C2SC4=CC=CC=C4N)OCCCC)C(=NC3=N)N)OCCCC

InChI

InChI=1S/C36H49N5O2S2/c1-5-9-21-41(22-10-6-2)25-17-19-26(20-18-25)44-33-31(42-23-11-7-3)29-30(36(39)40-35(29)38)32(43-24-12-8-4)34(33)45-28-16-14-13-15-27(28)37/h13-20H,5-12,21-24,37H2,1-4H3,(H3,38,39,40)