sulfanyl 3-formamido-4-methyl-2-(phenylmethyl)benzoate

Systemtic Name: sulfanyl 3-formamido-4-methyl-2-(phenylmethyl)benzoate Openeye Name: sulfanyl 2-benzyl-3-formamido-4-methyl-benzoate CAS Name: 3-formamido-4-methyl-2-(phenylmethyl)benzoic acid mercapto ester IUPAC Name: sulfanyl 2-benzyl-3-formamido-4-methylbenzoate Traditional Name: 2-benzyl-3-formamido-4-methyl-benzoic acid mercapto ester Formula: C16H15NO3S MolecularWeight: 301.3602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C(=O)OS)CC2=CC=CC=C2)NC=O

Isomeric SMILES

CC1=C(C(=C(C=C1)C(=O)OS)CC2=CC=CC=C2)NC=O

InChI

InChI=1S/C16H15NO3S/c1-11-7-8-13(16(19)20-21)14(15(11)17-10-18)9-12-5-3-2-4-6-12/h2-8,10,21H,9H2,1H3,(H,17,18)