methyl 4-[[3-(2-ethoxy-2-oxidanylidene-ethyl)-4-methyl-1,3-benzothiazol-2-ylidene]carbamoyl]benzoate

Systemtic Name: methyl 4-[[3-(2-ethoxy-2-oxidanylidene-ethyl)-4-methyl-1,3-benzothiazol-2-ylidene]carbamoyl]benzoate Openeye Name: methyl 4-[[3-(2-ethoxy-2-oxo-ethyl)-4-methyl-1,3-benzothiazol-2-ylidene]carbamoyl]benzoate CAS Name: 4-[[[3-(2-ethoxy-2-oxoethyl)-4-methyl-1,3-benzothiazol-2-ylidene]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-(2-ethoxy-2-oxoethyl)-4-methyl-1,3-benzothiazol-2-ylidene]carbamoyl]benzoate Traditional Name: 4-[[3-(2-ethoxy-2-keto-ethyl)-4-methyl-1,3-benzothiazol-2-ylidene]carbamoyl]benzoic acid methyl ester Formula: C21H20N2O5S MolecularWeight: 412.4589

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=CC=C2SC1=NC(=O)C3=CC=C(C=C3)C(=O)OC)C

Isomeric SMILES

CCOC(=O)CN1C2=C(C=CC=C2SC1=NC(=O)C3=CC=C(C=C3)C(=O)OC)C

InChI

InChI=1S/C21H20N2O5S/c1-4-28-17(24)12-23-18-13(2)6-5-7-16(18)29-21(23)22-19(25)14-8-10-15(11-9-14)20(26)27-3/h5-11H,4,12H2,1-3H3