1-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-(diphenylmethyl)piperazine

Systemtic Name: 1-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-(diphenylmethyl)piperazine Openeye Name: 1-benzhydryl-4-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine CAS Name: 1-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-(diphenylmethyl)piperazine IUPAC Name: 1-benzhydryl-4-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine Traditional Name: 1-benzhydryl-4-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine Formula: C31H30N2S MolecularWeight: 462.6483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2CC3=CC=CC=C3SC4=CC=CC=C24)C(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1C2CC3=CC=CC=C3SC4=CC=CC=C24)C(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C31H30N2S/c1-3-11-24(12-4-1)31(25-13-5-2-6-14-25)33-21-19-32(20-22-33)28-23-26-15-7-9-17-29(26)34-30-18-10-8-16-27(28)30/h1-18,28,31H,19-23H2