ethyl 4-[[3-heptyl-6-(methylcarbamoyl)-4-oxidanylidene-1,3-thiazinan-2-ylidene]amino]benzoate

Systemtic Name: ethyl 4-[[3-heptyl-6-(methylcarbamoyl)-4-oxidanylidene-1,3-thiazinan-2-ylidene]amino]benzoate Openeye Name: ethyl 4-[[3-heptyl-6-(methylcarbamoyl)-4-oxo-1,3-thiazinan-2-ylidene]amino]benzoate CAS Name: 4-[[3-heptyl-6-(methylcarbamoyl)-4-oxo-1,3-thiazinan-2-ylidene]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[3-heptyl-6-(methylcarbamoyl)-4-oxo-1,3-thiazinan-2-ylidene]amino]benzoate Traditional Name: 4-[[3-heptyl-4-keto-6-(methylcarbamoyl)-1,3-thiazinan-2-ylidene]amino]benzoic acid ethyl ester Formula: C22H31N3O4S MolecularWeight: 433.56424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C(=O)CC(SC1=NC2=CC=C(C=C2)C(=O)OCC)C(=O)NC

Isomeric SMILES

CCCCCCCN1C(=O)CC(SC1=NC2=CC=C(C=C2)C(=O)OCC)C(=O)NC

InChI

InChI=1S/C22H31N3O4S/c1-4-6-7-8-9-14-25-19(26)15-18(20(27)23-3)30-22(25)24-17-12-10-16(11-13-17)21(28)29-5-2/h10-13,18H,4-9,14-15H2,1-3H3,(H,23,27)