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

Systemtic Name: ethyl 4-[[3-heptyl-4-oxidanylidene-6-[(4-propoxyphenyl)carbamoyl]-1,3-thiazinan-2-ylidene]amino]benzoate Openeye Name: ethyl 4-[[3-heptyl-4-oxo-6-[(4-propoxyphenyl)carbamoyl]-1,3-thiazinan-2-ylidene]amino]benzoate CAS Name: 4-[[3-heptyl-4-oxo-6-[oxo-(4-propoxyanilino)methyl]-1,3-thiazinan-2-ylidene]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[3-heptyl-4-oxo-6-[(4-propoxyphenyl)carbamoyl]-1,3-thiazinan-2-ylidene]amino]benzoate Traditional Name: 4-[[3-heptyl-4-keto-6-[(4-propoxyphenyl)carbamoyl]-1,3-thiazinan-2-ylidene]amino]benzoic acid ethyl ester Formula: C30H39N3O5S MolecularWeight: 553.71276

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C(=O)CC(SC1=NC2=CC=C(C=C2)C(=O)OCC)C(=O)NC3=CC=C(C=C3)OCCC

Isomeric SMILES

CCCCCCCN1C(=O)CC(SC1=NC2=CC=C(C=C2)C(=O)OCC)C(=O)NC3=CC=C(C=C3)OCCC

InChI

InChI=1S/C30H39N3O5S/c1-4-7-8-9-10-19-33-27(34)21-26(28(35)31-23-15-17-25(18-16-23)38-20-5-2)39-30(33)32-24-13-11-22(12-14-24)29(36)37-6-3/h11-18,26H,4-10,19-21H2,1-3H3,(H,31,35)