methyl 4-[[2-(3-chlorophenyl)imino-3-heptyl-4-oxidanylidene-1,3-thiazinan-6-yl]carbonylamino]benzoate

Systemtic Name: methyl 4-[[2-(3-chlorophenyl)imino-3-heptyl-4-oxidanylidene-1,3-thiazinan-6-yl]carbonylamino]benzoate Openeye Name: methyl 4-[[2-(3-chlorophenyl)imino-3-heptyl-4-oxo-1,3-thiazinane-6-carbonyl]amino]benzoate CAS Name: 4-[[[2-(3-chlorophenyl)imino-3-heptyl-4-oxo-1,3-thiazinan-6-yl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(3-chlorophenyl)imino-3-heptyl-4-oxo-1,3-thiazinane-6-carbonyl]amino]benzoate Traditional Name: 4-[[2-(3-chlorophenyl)imino-3-heptyl-4-keto-1,3-thiazinane-6-carbonyl]amino]benzoic acid methyl ester Formula: C26H30ClN3O4S MolecularWeight: 516.0521

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C(=O)CC(SC1=NC2=CC(=CC=C2)Cl)C(=O)NC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCCCCCCN1C(=O)CC(SC1=NC2=CC(=CC=C2)Cl)C(=O)NC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C26H30ClN3O4S/c1-3-4-5-6-7-15-30-23(31)17-22(35-26(30)29-21-10-8-9-19(27)16-21)24(32)28-20-13-11-18(12-14-20)25(33)34-2/h8-14,16,22H,3-7,15,17H2,1-2H3,(H,28,32)