2-[[(11Z)-11-ethyl-12-phenyl-6H-benzo[c][1]benzothiocin-3-yl]oxy]-N,N-dimethyl-ethanamine

Systemtic Name: 2-[[(11Z)-11-ethyl-12-phenyl-6H-benzo[c][1]benzothiocin-3-yl]oxy]-N,N-dimethyl-ethanamine Openeye Name: 2-[[(11Z)-11-ethyl-12-phenyl-6H-benzo[c][1]benzothiocin-3-yl]oxy]-N,N-dimethyl-ethanamine CAS Name: 2-[[(11Z)-11-ethyl-12-phenyl-6H-benzo[c][1]benzothiocin-3-yl]oxy]-N,N-dimethylethanamine IUPAC Name: 2-[[(11Z)-11-ethyl-12-phenyl-6H-benzo[c][1]benzothiocin-3-yl]oxy]-N,N-dimethylethanamine Traditional Name: 2-[[(11Z)-11-ethyl-12-phenyl-6H-benzo[c][1]benzothiocin-3-yl]oxy]ethyl-dimethyl-amine Formula: C27H29NOS MolecularWeight: 415.59026

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(C=C(C=C2)OCCN(C)C)SCC3=CC=CC=C31)C4=CC=CC=C4

Isomeric SMILES

CC/C/1=C(/C2=C(C=C(C=C2)OCCN(C)C)SCC3=CC=CC=C31)\C4=CC=CC=C4

InChI

InChI=1S/C27H29NOS/c1-4-23-24-13-9-8-12-21(24)19-30-26-18-22(29-17-16-28(2)3)14-15-25(26)27(23)20-10-6-5-7-11-20/h5-15,18H,4,16-17,19H2,1-3H3/b27-23-