6-butyl-9-heptyl-7,8,12-trithia-1,14-diazabicyclo[9.3.0]tetradec-13-ene-2,10-diol

Systemtic Name: 6-butyl-9-heptyl-7,8,12-trithia-1,14-diazabicyclo[9.3.0]tetradec-13-ene-2,10-diol Openeye Name: 6-butyl-9-heptyl-7,8,12-trithia-1,14-diazabicyclo[9.3.0]tetradec-13-ene-2,10-diol CAS Name: 6-butyl-9-heptyl-7,8,12-trithia-1,14-diazabicyclo[9.3.0]tetradec-13-ene-2,10-diol IUPAC Name: 6-butyl-9-heptyl-7,8,12-trithia-1,14-diazabicyclo[9.3.0]tetradec-13-ene-2,10-diol Traditional Name: 6-butyl-9-heptyl-7,8,12-trithia-1,14-diazabicyclo[9.3.0]tetradec-13-ene-2,10-diol Formula: C20H38N2O2S3 MolecularWeight: 434.72292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1C(C2N(C(CCCC(SS1)CCCC)O)N=CS2)O

Isomeric SMILES

CCCCCCCC1C(C2N(C(CCCC(SS1)CCCC)O)N=CS2)O

InChI

InChI=1S/C20H38N2O2S3/c1-3-5-7-8-9-13-17-19(24)20-22(21-15-25-20)18(23)14-10-12-16(26-27-17)11-6-4-2/h15-20,23-24H,3-14H2,1-2H3