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

Systemtic Name: ethyl 4-[[6-[(3-chloranyl-4-methyl-phenyl)carbamoyl]-4-oxidanylidene-3-phenethyl-1,3-thiazinan-2-ylidene]amino]benzoate Openeye Name: ethyl 4-[[6-[(3-chloro-4-methyl-phenyl)carbamoyl]-4-oxo-3-phenethyl-1,3-thiazinan-2-ylidene]amino]benzoate CAS Name: 4-[[6-[(3-chloro-4-methylanilino)-oxomethyl]-4-oxo-3-phenethyl-1,3-thiazinan-2-ylidene]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[6-[(3-chloro-4-methylphenyl)carbamoyl]-4-oxo-3-phenethyl-1,3-thiazinan-2-ylidene]amino]benzoate Traditional Name: 4-[[6-[(3-chloro-4-methyl-phenyl)carbamoyl]-4-keto-3-phenethyl-1,3-thiazinan-2-ylidene]amino]benzoic acid ethyl ester Formula: C29H28ClN3O4S MolecularWeight: 550.06832

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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=CC(=C(C=C3)C)Cl)CCC4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C29H28ClN3O4S/c1-3-37-28(36)21-10-13-22(14-11-21)32-29-33(16-15-20-7-5-4-6-8-20)26(34)18-25(38-29)27(35)31-23-12-9-19(2)24(30)17-23/h4-14,17,25H,3,15-16,18H2,1-2H3,(H,31,35)