2-(2-chloroethylsulfanyl)-N-[(12-methylbenzo[a]anthracen-7-yl)methyl]ethanamine

Systemtic Name: 2-(2-chloroethylsulfanyl)-N-[(12-methylbenzo[a]anthracen-7-yl)methyl]ethanamine Openeye Name: 2-(2-chloroethylsulfanyl)-N-[(12-methylbenzo[a]anthracen-7-yl)methyl]ethanamine CAS Name: 2-(2-chloroethylthio)-N-[(12-methyl-7-benzo[a]anthracenyl)methyl]ethanamine IUPAC Name: 2-(2-chloroethylsulfanyl)-N-[(12-methylbenzo[a]anthracen-7-yl)methyl]ethanamine Traditional Name: 2-(2-chloroethylthio)ethyl-[(12-methylbenz[a]anthracen-7-yl)methyl]amine Formula: C24H24ClNS MolecularWeight: 393.97206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C3=CC=CC=C13)CNCCSCCCl)C=CC4=CC=CC=C42

Isomeric SMILES

CC1=C2C(=C(C3=CC=CC=C13)CNCCSCCCl)C=CC4=CC=CC=C42

InChI

InChI=1S/C24H24ClNS/c1-17-19-7-4-5-9-21(19)23(16-26-13-15-27-14-12-25)22-11-10-18-6-2-3-8-20(18)24(17)22/h2-11,26H,12-16H2,1H3