methyl 3-[2-[(2E)-2-(phenylmethylidene)hydrazinyl]-1,3-thiazol-4-yl]azulene-1-carboxylate

Systemtic Name: methyl 3-[2-[(2E)-2-(phenylmethylidene)hydrazinyl]-1,3-thiazol-4-yl]azulene-1-carboxylate Openeye Name: methyl 3-[2-[(2E)-2-benzylidenehydrazino]thiazol-4-yl]azulene-1-carboxylate CAS Name: 3-[2-[(2E)-2-(phenylmethylene)hydrazinyl]-4-thiazolyl]-1-azulenecarboxylic acid methyl ester IUPAC Name: methyl 3-[2-[(2E)-2-benzylidenehydrazinyl]-1,3-thiazol-4-yl]azulene-1-carboxylate Traditional Name: 3-[2-[(N'E)-N'-benzalhydrazino]thiazol-4-yl]azulene-1-carboxylic acid methyl ester Formula: C22H17N3O2S MolecularWeight: 387.45428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2C=CC=CC=C2C(=C1)C3=CSC(=N3)NN=CC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=C2C=CC=CC=C2C(=C1)C3=CSC(=N3)N/N=C/C4=CC=CC=C4

InChI

InChI=1S/C22H17N3O2S/c1-27-21(26)19-12-18(16-10-6-3-7-11-17(16)19)20-14-28-22(24-20)25-23-13-15-8-4-2-5-9-15/h2-14H,1H3,(H,24,25)/b23-13+