7,16-bis(naphthalen-2-ylsulfanylmethyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane

Systemtic Name: 7,16-bis(naphthalen-2-ylsulfanylmethyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane Openeye Name: 7,16-bis(2-naphthylsulfanylmethyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane CAS Name: 7,16-bis[(2-naphthalenylthio)methyl]-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane IUPAC Name: 7,16-bis(naphthalen-2-ylsulfanylmethyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane Traditional Name: 7,16-bis[(2-naphthylthio)methyl]-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane Formula: C34H42N2O4S2 MolecularWeight: 606.83828

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCOCCN(CCOCCOCCN1CSC2=CC3=CC=CC=C3C=C2)CSC4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1COCCOCCN(CCOCCOCCN1CSC2=CC3=CC=CC=C3C=C2)CSC4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C34H42N2O4S2/c1-3-7-31-25-33(11-9-29(31)5-1)41-27-35-13-17-37-21-23-39-19-15-36(16-20-40-24-22-38-18-14-35)28-42-34-12-10-30-6-2-4-8-32(30)26-34/h1-12,25-26H,13-24,27-28H2