ethyl 4-[[(3-azanylidene-5-methyl-1,2-thiazol-2-yl)-phenylazanyl-methylidene]amino]benzoate

Systemtic Name: ethyl 4-[[(3-azanylidene-5-methyl-1,2-thiazol-2-yl)-phenylazanyl-methylidene]amino]benzoate Openeye Name: ethyl 4-[[anilino-(3-imino-5-methyl-isothiazol-2-yl)methylene]amino]benzoate CAS Name: 4-[[anilino-(3-imino-5-methyl-2-isothiazolyl)methylidene]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[anilino-(3-imino-5-methyl-1,2-thiazol-2-yl)methylidene]amino]benzoate Traditional Name: 4-[[anilino-(3-imino-5-methyl-4-isothiazolin-2-yl)methylene]amino]benzoic acid ethyl ester Formula: C20H20N4O2S MolecularWeight: 380.4634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N=C(NC2=CC=CC=C2)N3C(=N)C=C(S3)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N=C(NC2=CC=CC=C2)N3C(=N)C=C(S3)C

InChI

InChI=1S/C20H20N4O2S/c1-3-26-19(25)15-9-11-17(12-10-15)23-20(22-16-7-5-4-6-8-16)24-18(21)13-14(2)27-24/h4-13,21H,3H2,1-2H3,(H,22,23)