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

Systemtic Name: ethyl 4-[[6-[(2,4-dimethylphenyl)carbamoyl]-3-heptyl-4-oxidanylidene-1,3-thiazinan-2-ylidene]amino]benzoate Openeye Name: ethyl 4-[[6-[(2,4-dimethylphenyl)carbamoyl]-3-heptyl-4-oxo-1,3-thiazinan-2-ylidene]amino]benzoate CAS Name: 4-[[6-[(2,4-dimethylanilino)-oxomethyl]-3-heptyl-4-oxo-1,3-thiazinan-2-ylidene]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[6-[(2,4-dimethylphenyl)carbamoyl]-3-heptyl-4-oxo-1,3-thiazinan-2-ylidene]amino]benzoate Traditional Name: 4-[[6-[(2,4-dimethylphenyl)carbamoyl]-3-heptyl-4-keto-1,3-thiazinan-2-ylidene]amino]benzoic acid ethyl ester Formula: C29H37N3O4S MolecularWeight: 523.68678

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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=C(C=C(C=C3)C)C

Isomeric SMILES

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

InChI

InChI=1S/C29H37N3O4S/c1-5-7-8-9-10-17-32-26(33)19-25(27(34)31-24-16-11-20(3)18-21(24)4)37-29(32)30-23-14-12-22(13-15-23)28(35)36-6-2/h11-16,18,25H,5-10,17,19H2,1-4H3,(H,31,34)