N,N-diethyl-2-[(4-methyl-6,11-dihydrobenzo[c][1]benzoxepin-11-yl)sulfanyl]ethanamine

Systemtic Name: N,N-diethyl-2-[(4-methyl-6,11-dihydrobenzo[c][1]benzoxepin-11-yl)sulfanyl]ethanamine Openeye Name: N,N-diethyl-2-[(4-methyl-6,11-dihydrobenzo[c][1]benzoxepin-11-yl)sulfanyl]ethanamine CAS Name: N,N-diethyl-2-[(4-methyl-6,11-dihydrobenzo[c][1]benzoxepin-11-yl)thio]ethanamine IUPAC Name: N,N-diethyl-2-[(4-methyl-6,11-dihydrobenzo[c][1]benzoxepin-11-yl)sulfanyl]ethanamine Traditional Name: diethyl-[2-[(4-methyl-6,11-dihydrobenzo[c][1]benzoxepin-11-yl)thio]ethyl]amine Formula: C21H27NOS MolecularWeight: 341.51018

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCSC1C2=C(C(=CC=C2)C)OCC3=CC=CC=C13

Isomeric SMILES

CCN(CC)CCSC1C2=C(C(=CC=C2)C)OCC3=CC=CC=C13

InChI

InChI=1S/C21H27NOS/c1-4-22(5-2)13-14-24-21-18-11-7-6-10-17(18)15-23-20-16(3)9-8-12-19(20)21/h6-12,21H,4-5,13-15H2,1-3H3