methyl 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-4-pyrrolidin-1-ylcarbothioylsulfanyl-butanoate

Systemtic Name: methyl 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-4-pyrrolidin-1-ylcarbothioylsulfanyl-butanoate Openeye Name: methyl 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-4-(pyrrolidine-1-carbothioylsulfanyl)butanoate CAS Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-4-[[1-pyrrolidinyl(sulfanylidene)methyl]thio]butanoic acid methyl ester IUPAC Name: methyl 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-4-(pyrrolidine-1-carbothioylsulfanyl)butanoate Traditional Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-keto-4-(pyrrolidine-1-carbothioylthio)butyric acid methyl ester Formula: C17H19N3O3S2 MolecularWeight: 377.48106

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=C1NC2=CC=CC=C2N1)C(=O)CSC(=S)N3CCCC3

Isomeric SMILES

COC(=O)C(=C1NC2=CC=CC=C2N1)C(=O)CSC(=S)N3CCCC3

InChI

InChI=1S/C17H19N3O3S2/c1-23-16(22)14(15-18-11-6-2-3-7-12(11)19-15)13(21)10-25-17(24)20-8-4-5-9-20/h2-3,6-7,18-19H,4-5,8-10H2,1H3