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2,4-bis(2-pentyl-1,3-benzodithiol-2-yl)-1H-pyrrole

2,4-bis(2-pentyl-1,3-benzodithiol-2-yl)-1H-pyrrole

Systemtic Name:2,4-bis(2-pentyl-1,3-benzodithiol-2-yl)-1H-pyrrole
Openeye Name:2,4-bis(2-pentyl-1,3-benzodithiol-2-yl)-1H-pyrrole
CAS Name:2,4-bis(2-pentyl-1,3-benzodithiol-2-yl)-1H-pyrrole
IUPAC Name:2,4-bis(2-pentyl-1,3-benzodithiol-2-yl)-1H-pyrrole
Traditional Name:2,4-bis(2-amyl-1,3-benzodithiol-2-yl)-1H-pyrrole
Formula: C28H33NS4
MolecularWeight: 511.82832
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1(SC2=CC=CC=C2S1)C3=CC(=CN3)C4(SC5=CC=CC=C5S4)CCCCC


Isomeric SMILES

CCCCCC1(SC2=CC=CC=C2S1)C3=CC(=CN3)C4(SC5=CC=CC=C5S4)CCCCC


InChI

InChI=1S/C28H33NS4/c1-3-5-11-17-27(30-22-13-7-8-14-23(22)31-27)21-19-26(29-20-21)28(18-12-6-4-2)32-24-15-9-10-16-25(24)33-28/h7-10,13-16,19-20,29H,3-6,11-12,17-18H2,1-2H3


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