S-tert-butyl 5-azanyl-2-methyl-benzenecarbothioate

Systemtic Name: S-tert-butyl 5-azanyl-2-methyl-benzenecarbothioate Openeye Name: S-tert-butyl 5-amino-2-methyl-benzenecarbothioate CAS Name: 5-amino-2-methylbenzenecarbothioic acid S-tert-butyl ester IUPAC Name: S-tert-butyl 5-amino-2-methylbenzenecarbothioate Traditional Name: 5-amino-2-methyl-thiobenzoic acid S-tert-butyl ester Formula: C12H17NOS MolecularWeight: 223.33448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N)C(=O)SC(C)(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N)C(=O)SC(C)(C)C

InChI

InChI=1S/C12H17NOS/c1-8-5-6-9(13)7-10(8)11(14)15-12(2,3)4/h5-7H,13H2,1-4H3