ethyl 2-[3-(phenylcarbonyl)-2-(phenylcarbonylimino)-6H-1,3,4-thiadiazin-5-yl]ethanoate

Systemtic Name: ethyl 2-[3-(phenylcarbonyl)-2-(phenylcarbonylimino)-6H-1,3,4-thiadiazin-5-yl]ethanoate Openeye Name: ethyl 2-(3-benzoyl-2-benzoylimino-6H-1,3,4-thiadiazin-5-yl)acetate CAS Name: 2-(3-benzoyl-2-benzoylimino-6H-1,3,4-thiadiazin-5-yl)acetic acid ethyl ester IUPAC Name: ethyl 2-(3-benzoyl-2-benzoylimino-6H-1,3,4-thiadiazin-5-yl)acetate Traditional Name: 2-(3-benzoyl-2-benzoylimino-6H-1,3,4-thiadiazin-5-yl)acetic acid ethyl ester Formula: C21H19N3O4S MolecularWeight: 409.45826

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=NN(C(=NC(=O)C2=CC=CC=C2)SC1)C(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CC1=NN(C(=NC(=O)C2=CC=CC=C2)SC1)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H19N3O4S/c1-2-28-18(25)13-17-14-29-21(22-19(26)15-9-5-3-6-10-15)24(23-17)20(27)16-11-7-4-8-12-16/h3-12H,2,13-14H2,1H3