methyl 3-(5-cyclohexylimino-4-methyl-1,3,4-thiadiazol-2-yl)benzoate

Systemtic Name: methyl 3-(5-cyclohexylimino-4-methyl-1,3,4-thiadiazol-2-yl)benzoate Openeye Name: methyl 3-(5-cyclohexylimino-4-methyl-1,3,4-thiadiazol-2-yl)benzoate CAS Name: 3-(5-cyclohexylimino-4-methyl-1,3,4-thiadiazol-2-yl)benzoic acid methyl ester IUPAC Name: methyl 3-(5-cyclohexylimino-4-methyl-1,3,4-thiadiazol-2-yl)benzoate Traditional Name: 3-(5-cyclohexylimino-4-methyl-1,3,4-thiadiazol-2-yl)benzoic acid methyl ester Formula: C17H21N3O2S MolecularWeight: 331.43254

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC2CCCCC2)SC(=N1)C3=CC(=CC=C3)C(=O)OC

Isomeric SMILES

CN1C(=NC2CCCCC2)SC(=N1)C3=CC(=CC=C3)C(=O)OC

InChI

InChI=1S/C17H21N3O2S/c1-20-17(18-14-9-4-3-5-10-14)23-15(19-20)12-7-6-8-13(11-12)16(21)22-2/h6-8,11,14H,3-5,9-10H2,1-2H3