5-dodecoxy-4-methoxy-3H-2-benzothiophene-1-thione

Systemtic Name: 5-dodecoxy-4-methoxy-3H-2-benzothiophene-1-thione Openeye Name: 5-dodecoxy-4-methoxy-3H-2-benzothiophene-1-thione CAS Name: 5-dodecoxy-4-methoxy-3H-2-benzothiophene-1-thione IUPAC Name: 5-dodecoxy-4-methoxy-3H-2-benzothiophene-1-thione Traditional Name: 5-lauryloxy-4-methoxy-3H-isobenzothiophene-1-thione Formula: C21H32O2S2 MolecularWeight: 380.60758

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=C(C2=C(C=C1)C(=S)SC2)OC

Isomeric SMILES

CCCCCCCCCCCCOC1=C(C2=C(C=C1)C(=S)SC2)OC

InChI

InChI=1S/C21H32O2S2/c1-3-4-5-6-7-8-9-10-11-12-15-23-19-14-13-17-18(20(19)22-2)16-25-21(17)24/h13-14H,3-12,15-16H2,1-2H3