methyl 5-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-2-methyl-furan-3-carboxylate

Systemtic Name: methyl 5-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-2-methyl-furan-3-carboxylate Openeye Name: methyl 5-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-2-methyl-furan-3-carboxylate CAS Name: 5-[[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]-2-methyl-3-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-2-methylfuran-3-carboxylate Traditional Name: 5-[[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]-2-methyl-furan-3-carboxylic acid methyl ester Formula: C16H21N3O3S2 MolecularWeight: 367.48624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CSC2=NN=C(S2)NC3CCCCC3)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)CSC2=NN=C(S2)NC3CCCCC3)C(=O)OC

InChI

InChI=1S/C16H21N3O3S2/c1-10-13(14(20)21-2)8-12(22-10)9-23-16-19-18-15(24-16)17-11-6-4-3-5-7-11/h8,11H,3-7,9H2,1-2H3,(H,17,18)