methyl 5-(2-azanylethylsulfanylmethyl)-3-methyl-furan-2-carboxylate

Systemtic Name: methyl 5-(2-azanylethylsulfanylmethyl)-3-methyl-furan-2-carboxylate Openeye Name: methyl 5-(2-aminoethylsulfanylmethyl)-3-methyl-furan-2-carboxylate CAS Name: 5-[(2-aminoethylthio)methyl]-3-methyl-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-(2-aminoethylsulfanylmethyl)-3-methylfuran-2-carboxylate Traditional Name: 5-[(2-aminoethylthio)methyl]-3-methyl-furan-2-carboxylic acid methyl ester Formula: C10H15NO3S MolecularWeight: 229.296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1)CSCCN)C(=O)OC

Isomeric SMILES

CC1=C(OC(=C1)CSCCN)C(=O)OC

InChI

InChI=1S/C10H15NO3S/c1-7-5-8(6-15-4-3-11)14-9(7)10(12)13-2/h5H,3-4,6,11H2,1-2H3