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

Systemtic Name: ethyl 4-[[3-heptyl-6-[(2-methoxyphenyl)carbamoyl]-4-oxidanylidene-1,3-thiazinan-2-ylidene]amino]benzoate Openeye Name: ethyl 4-[[3-heptyl-6-[(2-methoxyphenyl)carbamoyl]-4-oxo-1,3-thiazinan-2-ylidene]amino]benzoate CAS Name: 4-[[3-heptyl-6-[(2-methoxyanilino)-oxomethyl]-4-oxo-1,3-thiazinan-2-ylidene]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[3-heptyl-6-[(2-methoxyphenyl)carbamoyl]-4-oxo-1,3-thiazinan-2-ylidene]amino]benzoate Traditional Name: 4-[[3-heptyl-4-keto-6-[(2-methoxyphenyl)carbamoyl]-1,3-thiazinan-2-ylidene]amino]benzoic acid ethyl ester Formula: C28H35N3O5S MolecularWeight: 525.6596

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C(=O)CC(SC1=NC2=CC=C(C=C2)C(=O)OCC)C(=O)NC3=CC=CC=C3OC

Isomeric SMILES

CCCCCCCN1C(=O)CC(SC1=NC2=CC=C(C=C2)C(=O)OCC)C(=O)NC3=CC=CC=C3OC

InChI

InChI=1S/C28H35N3O5S/c1-4-6-7-8-11-18-31-25(32)19-24(26(33)30-22-12-9-10-13-23(22)35-3)37-28(31)29-21-16-14-20(15-17-21)27(34)36-5-2/h9-10,12-17,24H,4-8,11,18-19H2,1-3H3,(H,30,33)