methyl 4-azanylsulfanylcarbonyl-3-methyl-benzoate

Systemtic Name: methyl 4-azanylsulfanylcarbonyl-3-methyl-benzoate Openeye Name: methyl 4-aminosulfanylcarbonyl-3-methyl-benzoate CAS Name: 4-[(aminothio)-oxomethyl]-3-methylbenzoic acid methyl ester IUPAC Name: methyl 4-aminosulfanylcarbonyl-3-methylbenzoate Traditional Name: 4-(aminothio)carbonyl-3-methyl-benzoic acid methyl ester Formula: C10H11NO3S MolecularWeight: 225.26424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OC)C(=O)SN

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OC)C(=O)SN

InChI

InChI=1S/C10H11NO3S/c1-6-5-7(9(12)14-2)3-4-8(6)10(13)15-11/h3-5H,11H2,1-2H3