ethyl 4-[[4-(1,3-dithian-2-yl)phenyl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[4-(1,3-dithian-2-yl)phenyl]carbonylamino]benzoate Openeye Name: ethyl 4-[[4-(1,3-dithian-2-yl)benzoyl]amino]benzoate CAS Name: 4-[[[4-(1,3-dithian-2-yl)phenyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-(1,3-dithian-2-yl)benzoyl]amino]benzoate Traditional Name: 4-[[4-(1,3-dithian-2-yl)benzoyl]amino]benzoic acid ethyl ester Formula: C20H21NO3S2 MolecularWeight: 387.51564

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)C3SCCCS3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)C3SCCCS3

InChI

InChI=1S/C20H21NO3S2/c1-2-24-19(23)15-8-10-17(11-9-15)21-18(22)14-4-6-16(7-5-14)20-25-12-3-13-26-20/h4-11,20H,2-3,12-13H2,1H3,(H,21,22)