N-[4-(2-dimethylaminoethyloxy)phenyl]-2-methyl-6,11-dihydrobenzo[c][1]benzothiepin-11-amine

Systemtic Name: N-[4-(2-dimethylaminoethyloxy)phenyl]-2-methyl-6,11-dihydrobenzo[c][1]benzothiepin-11-amine Openeye Name: N-[4-(2-dimethylaminoethyloxy)phenyl]-2-methyl-6,11-dihydrobenzo[c][1]benzothiepin-11-amine CAS Name: N-[4-(2-dimethylaminoethyloxy)phenyl]-2-methyl-6,11-dihydrobenzo[c][1]benzothiepin-11-amine IUPAC Name: N-[4-(2-dimethylaminoethyloxy)phenyl]-2-methyl-6,11-dihydrobenzo[c][1]benzothiepin-11-amine Traditional Name: dimethyl-[2-[4-[(2-methyl-6,11-dihydrobenzo[c][1]benzothiepin-11-yl)amino]phenoxy]ethyl]amine Formula: C25H28N2OS MolecularWeight: 404.56762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SCC3=CC=CC=C3C2NC4=CC=C(C=C4)OCCN(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)SCC3=CC=CC=C3C2NC4=CC=C(C=C4)OCCN(C)C

InChI

InChI=1S/C25H28N2OS/c1-18-8-13-24-23(16-18)25(22-7-5-4-6-19(22)17-29-24)26-20-9-11-21(12-10-20)28-15-14-27(2)3/h4-13,16,25-26H,14-15,17H2,1-3H3