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

Systemtic Name: ethyl 4-[[6-[(2,4-dimethylphenyl)carbamoyl]-4-oxidanylidene-3-phenethyl-1,3-thiazinan-2-ylidene]amino]benzoate Openeye Name: ethyl 4-[[6-[(2,4-dimethylphenyl)carbamoyl]-4-oxo-3-phenethyl-1,3-thiazinan-2-ylidene]amino]benzoate CAS Name: 4-[[6-[(2,4-dimethylanilino)-oxomethyl]-4-oxo-3-phenethyl-1,3-thiazinan-2-ylidene]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[6-[(2,4-dimethylphenyl)carbamoyl]-4-oxo-3-phenethyl-1,3-thiazinan-2-ylidene]amino]benzoate Traditional Name: 4-[[6-[(2,4-dimethylphenyl)carbamoyl]-4-keto-3-phenethyl-1,3-thiazinan-2-ylidene]amino]benzoic acid ethyl ester Formula: C30H31N3O4S MolecularWeight: 529.64984

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N=C2N(C(=O)CC(S2)C(=O)NC3=C(C=C(C=C3)C)C)CCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N=C2N(C(=O)CC(S2)C(=O)NC3=C(C=C(C=C3)C)C)CCC4=CC=CC=C4

InChI

InChI=1S/C30H31N3O4S/c1-4-37-29(36)23-11-13-24(14-12-23)31-30-33(17-16-22-8-6-5-7-9-22)27(34)19-26(38-30)28(35)32-25-15-10-20(2)18-21(25)3/h5-15,18,26H,4,16-17,19H2,1-3H3,(H,32,35)