4-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-amine

Systemtic Name: 4-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-amine Openeye Name: 4-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-amine CAS Name: 4-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-1-piperazinamine IUPAC Name: 4-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-amine Traditional Name: [4-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazino]amine Formula: C18H21N3S MolecularWeight: 311.44444

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2CC3=CC=CC=C3SC4=CC=CC=C24)N

Isomeric SMILES

C1CN(CCN1C2CC3=CC=CC=C3SC4=CC=CC=C24)N

InChI

InChI=1S/C18H21N3S/c19-21-11-9-20(10-12-21)16-13-14-5-1-3-7-17(14)22-18-8-4-2-6-15(16)18/h1-8,16H,9-13,19H2