N'-(3-chloranyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)ethane-1,2-diamine

Systemtic Name: N'-(3-chloranyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)ethane-1,2-diamine Openeye Name: N'-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)ethane-1,2-diamine CAS Name: N'-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)ethane-1,2-diamine IUPAC Name: N'-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)ethane-1,2-diamine Traditional Name: 2-aminoethyl-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)amine Formula: C16H17ClN2S MolecularWeight: 304.83758

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=C(C=CC(=C2)Cl)SC3=CC=CC=C31)NCCN

Isomeric SMILES

C1C(C2=C(C=CC(=C2)Cl)SC3=CC=CC=C31)NCCN

InChI

InChI=1S/C16H17ClN2S/c17-12-5-6-16-13(10-12)14(19-8-7-18)9-11-3-1-2-4-15(11)20-16/h1-6,10,14,19H,7-9,18H2