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

Systemtic Name: ethyl 4-[(6-aminocarbonyl-4-oxidanylidene-3-phenethyl-1,3-thiazinan-2-ylidene)amino]benzoate Openeye Name: ethyl 4-[(6-carbamoyl-4-oxo-3-phenethyl-1,3-thiazinan-2-ylidene)amino]benzoate CAS Name: 4-[(6-carbamoyl-4-oxo-3-phenethyl-1,3-thiazinan-2-ylidene)amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(6-carbamoyl-4-oxo-3-phenethyl-1,3-thiazinan-2-ylidene)amino]benzoate Traditional Name: 4-[(6-carbamoyl-4-keto-3-phenethyl-1,3-thiazinan-2-ylidene)amino]benzoic acid ethyl ester Formula: C22H23N3O4S MolecularWeight: 425.50072

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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)N)CCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N=C2N(C(=O)CC(S2)C(=O)N)CCC3=CC=CC=C3

InChI

InChI=1S/C22H23N3O4S/c1-2-29-21(28)16-8-10-17(11-9-16)24-22-25(13-12-15-6-4-3-5-7-15)19(26)14-18(30-22)20(23)27/h3-11,18H,2,12-14H2,1H3,(H2,23,27)