methyl N'-(6-oxidanylidene-5,11-dihydrobenzo[c][1]benzazepin-8-yl)carbamimidothioate

Systemtic Name: methyl N'-(6-oxidanylidene-5,11-dihydrobenzo[c][1]benzazepin-8-yl)carbamimidothioate Openeye Name: 2-methyl-3-(6-oxo-5,11-dihydrobenzo[c][1]benzazepin-8-yl)isothiourea CAS Name: N'-(6-oxo-5,11-dihydrobenzo[c][1]benzazepin-8-yl)carbamimidothioic acid methyl ester IUPAC Name: methyl N'-(6-oxo-5,11-dihydrobenzo[c][1]benzazepin-8-yl)carbamimidothioate Traditional Name: 3-(6-keto-5,11-dihydrobenzo[c][1]benzazepin-8-yl)-2-methyl-isothiourea Formula: C16H15N3OS MolecularWeight: 297.3748

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NC1=CC2=C(CC3=CC=CC=C3NC2=O)C=C1)N

Isomeric SMILES

CSC(=NC1=CC2=C(CC3=CC=CC=C3NC2=O)C=C1)N

InChI

InChI=1S/C16H15N3OS/c1-21-16(17)18-12-7-6-10-8-11-4-2-3-5-14(11)19-15(20)13(10)9-12/h2-7,9H,8H2,1H3,(H2,17,18)(H,19,20)