N1,N2-bis(octylsulfanyl)-N1,N2-diphenyl-benzene-1,2-dicarboxamide

Systemtic Name: N1,N2-bis(octylsulfanyl)-N1,N2-diphenyl-benzene-1,2-dicarboxamide Openeye Name: N1,N2-bis(octylsulfanyl)-N1,N2-diphenyl-phthalamide CAS Name: N1,N2-bis(octylthio)-N1,N2-diphenylbenzene-1,2-dicarboxamide IUPAC Name: 1-N,2-N-bis(octylsulfanyl)-1-N,2-N-diphenylbenzene-1,2-dicarboxamide Traditional Name: N,N'-bis(octylthio)-N,N'-diphenyl-phthalamide Formula: C36H48N2O2S2 MolecularWeight: 604.90852

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSN(C1=CC=CC=C1)C(=O)C2=CC=CC=C2C(=O)N(C3=CC=CC=C3)SCCCCCCCC

Isomeric SMILES

CCCCCCCCSN(C1=CC=CC=C1)C(=O)C2=CC=CC=C2C(=O)N(C3=CC=CC=C3)SCCCCCCCC

InChI

InChI=1S/C36H48N2O2S2/c1-3-5-7-9-11-21-29-41-37(31-23-15-13-16-24-31)35(39)33-27-19-20-28-34(33)36(40)38(32-25-17-14-18-26-32)42-30-22-12-10-8-6-4-2/h13-20,23-28H,3-12,21-22,29-30H2,1-2H3