methyl 2-(1,3-benzothiazol-2-ylsulfanyl)-3-phenylazanyl-3-sulfanylidene-propanoate

Systemtic Name: methyl 2-(1,3-benzothiazol-2-ylsulfanyl)-3-phenylazanyl-3-sulfanylidene-propanoate Openeye Name: methyl 3-anilino-2-(1,3-benzothiazol-2-ylsulfanyl)-3-thioxo-propanoate CAS Name: 3-anilino-2-(1,3-benzothiazol-2-ylthio)-3-sulfanylidenepropanoic acid methyl ester IUPAC Name: methyl 3-anilino-2-(1,3-benzothiazol-2-ylsulfanyl)-3-sulfanylidenepropanoate Traditional Name: 3-anilino-2-(1,3-benzothiazol-2-ylthio)-3-thioxo-propionic acid methyl ester Formula: C17H14N2O2S3 MolecularWeight: 374.50026

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C(=S)NC1=CC=CC=C1)SC2=NC3=CC=CC=C3S2

Isomeric SMILES

COC(=O)C(C(=S)NC1=CC=CC=C1)SC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H14N2O2S3/c1-21-16(20)14(15(22)18-11-7-3-2-4-8-11)24-17-19-12-9-5-6-10-13(12)23-17/h2-10,14H,1H3,(H,18,22)