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

Systemtic Name: ethyl 4-[[6-(ethylcarbamoyl)-4-oxidanylidene-3-(phenylmethyl)-1,3-thiazinan-2-ylidene]amino]benzoate Openeye Name: ethyl 4-[[3-benzyl-6-(ethylcarbamoyl)-4-oxo-1,3-thiazinan-2-ylidene]amino]benzoate CAS Name: 4-[[6-(ethylcarbamoyl)-4-oxo-3-(phenylmethyl)-1,3-thiazinan-2-ylidene]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[3-benzyl-6-(ethylcarbamoyl)-4-oxo-1,3-thiazinan-2-ylidene]amino]benzoate Traditional Name: 4-[[3-benzyl-6-(ethylcarbamoyl)-4-keto-1,3-thiazinan-2-ylidene]amino]benzoic acid ethyl ester Formula: C23H25N3O4S MolecularWeight: 439.5273

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1CC(=O)N(C(=NC2=CC=C(C=C2)C(=O)OCC)S1)CC3=CC=CC=C3

Isomeric SMILES

CCNC(=O)C1CC(=O)N(C(=NC2=CC=C(C=C2)C(=O)OCC)S1)CC3=CC=CC=C3

InChI

InChI=1S/C23H25N3O4S/c1-3-24-21(28)19-14-20(27)26(15-16-8-6-5-7-9-16)23(31-19)25-18-12-10-17(11-13-18)22(29)30-4-2/h5-13,19H,3-4,14-15H2,1-2H3,(H,24,28)