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

Systemtic Name: ethyl 4-[[6-[(3-bromophenyl)carbamoyl]-4-oxidanylidene-3-phenethyl-1,3-thiazinan-2-ylidene]amino]benzoate Openeye Name: ethyl 4-[[6-[(3-bromophenyl)carbamoyl]-4-oxo-3-phenethyl-1,3-thiazinan-2-ylidene]amino]benzoate CAS Name: 4-[[6-[(3-bromoanilino)-oxomethyl]-4-oxo-3-phenethyl-1,3-thiazinan-2-ylidene]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[6-[(3-bromophenyl)carbamoyl]-4-oxo-3-phenethyl-1,3-thiazinan-2-ylidene]amino]benzoate Traditional Name: 4-[[6-[(3-bromophenyl)carbamoyl]-4-keto-3-phenethyl-1,3-thiazinan-2-ylidene]amino]benzoic acid ethyl ester Formula: C28H26BrN3O4S MolecularWeight: 580.49274

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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(=CC=C3)Br)CCC4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C28H26BrN3O4S/c1-2-36-27(35)20-11-13-22(14-12-20)31-28-32(16-15-19-7-4-3-5-8-19)25(33)18-24(37-28)26(34)30-23-10-6-9-21(29)17-23/h3-14,17,24H,2,15-16,18H2,1H3,(H,30,34)