6,11-dihydrobenzo[c][1]benzoxepin-11-yl carbamimidothioate

Systemtic Name: 6,11-dihydrobenzo[c][1]benzoxepin-11-yl carbamimidothioate Openeye Name: 2-(6,11-dihydrobenzo[c][1]benzoxepin-11-yl)isothiourea CAS Name: carbamimidothioic acid 6,11-dihydrobenzo[c][1]benzoxepin-11-yl ester IUPAC Name: 6,11-dihydrobenzo[c][1]benzoxepin-11-yl carbamimidothioate Traditional Name: 2-(6,11-dihydrobenzo[c][1]benzoxepin-11-yl)isothiourea Formula: C15H14N2OS MolecularWeight: 270.34946

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(C3=CC=CC=C3O1)SC(=N)N

Isomeric SMILES

C1C2=CC=CC=C2C(C3=CC=CC=C3O1)SC(=N)N

InChI

InChI=1S/C15H14N2OS/c16-15(17)19-14-11-6-2-1-5-10(11)9-18-13-8-4-3-7-12(13)14/h1-8,14H,9H2,(H3,16,17)