methyl 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-4-propan-2-yloxycarbothioylsulfanyl-butanoate

Systemtic Name: methyl 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-4-propan-2-yloxycarbothioylsulfanyl-butanoate Openeye Name: methyl 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-isopropoxycarbothioylsulfanyl-3-oxo-butanoate CAS Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-4-[[propan-2-yloxy(sulfanylidene)methyl]thio]butanoic acid methyl ester IUPAC Name: methyl 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-4-propan-2-yloxycarbothioylsulfanylbutanoate Traditional Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-(isopropoxycarbothioylthio)-3-keto-butyric acid methyl ester Formula: C16H18N2O4S2 MolecularWeight: 366.45512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=S)SCC(=O)C(=C1NC2=CC=CC=C2N1)C(=O)OC

Isomeric SMILES

CC(C)OC(=S)SCC(=O)C(=C1NC2=CC=CC=C2N1)C(=O)OC

InChI

InChI=1S/C16H18N2O4S2/c1-9(2)22-16(23)24-8-12(19)13(15(20)21-3)14-17-10-6-4-5-7-11(10)18-14/h4-7,9,17-18H,8H2,1-3H3