5,6-bis(bromomethyl)-3-methyl-benzo[b][1]benzothiepine

Systemtic Name: 5,6-bis(bromomethyl)-3-methyl-benzo[b][1]benzothiepine Openeye Name: 5,6-bis(bromomethyl)-3-methyl-benzo[b][1]benzothiepine CAS Name: 5,6-bis(bromomethyl)-3-methylbenzo[b][1]benzothiepin IUPAC Name: 5,6-bis(bromomethyl)-3-methylbenzo[b][1]benzothiepine Traditional Name: 5,6-bis(bromomethyl)-3-methyl-benzo[b][1]benzothiepin Formula: C17H14Br2S MolecularWeight: 410.16606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC3=CC=CC=C3C(=C2CBr)CBr

Isomeric SMILES

CC1=CC2=C(C=C1)SC3=CC=CC=C3C(=C2CBr)CBr

InChI

InChI=1S/C17H14Br2S/c1-11-6-7-17-13(8-11)15(10-19)14(9-18)12-4-2-3-5-16(12)20-17/h2-8H,9-10H2,1H3