methyl 2-[(3-azanyl-3-sulfanylidene-propyl)-phenyl-amino]ethanoate

Systemtic Name: methyl 2-[(3-azanyl-3-sulfanylidene-propyl)-phenyl-amino]ethanoate Openeye Name: methyl 2-(N-(3-amino-3-thioxo-propyl)anilino)acetate CAS Name: 2-(N-(3-amino-3-sulfanylidenepropyl)anilino)acetic acid methyl ester IUPAC Name: methyl 2-(N-(3-amino-3-sulfanylidenepropyl)anilino)acetate Traditional Name: 2-(N-(3-amino-3-thioxo-propyl)anilino)acetic acid methyl ester Formula: C12H16N2O2S MolecularWeight: 252.33264

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN(CCC(=S)N)C1=CC=CC=C1

Isomeric SMILES

COC(=O)CN(CCC(=S)N)C1=CC=CC=C1

InChI

InChI=1S/C12H16N2O2S/c1-16-12(15)9-14(8-7-11(13)17)10-5-3-2-4-6-10/h2-6H,7-9H2,1H3,(H2,13,17)