S-methyl 4-(phenylmethyl)pyridine-3-carbothioate

Systemtic Name: S-methyl 4-(phenylmethyl)pyridine-3-carbothioate Openeye Name: S-methyl 4-benzylpyridine-3-carbothioate CAS Name: 4-(phenylmethyl)-3-pyridinecarbothioic acid S-methyl ester IUPAC Name: S-methyl 4-benzylpyridine-3-carbothioate Traditional Name: 4-benzylpyridine-3-carbothioic acid S-methyl ester Formula: C14H13NOS MolecularWeight: 243.32412

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=O)C1=C(C=CN=C1)CC2=CC=CC=C2

Isomeric SMILES

CSC(=O)C1=C(C=CN=C1)CC2=CC=CC=C2

InChI

InChI=1S/C14H13NOS/c1-17-14(16)13-10-15-8-7-12(13)9-11-5-3-2-4-6-11/h2-8,10H,9H2,1H3