methyl 5-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-ethoxycarbothioylsulfanyl-pentanoate

Systemtic Name: methyl 5-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-ethoxycarbothioylsulfanyl-pentanoate Openeye Name: methyl 5-(1,3-dioxoisoindolin-2-yl)-4-ethoxycarbothioylsulfanyl-pentanoate CAS Name: 5-(1,3-dioxo-2-isoindolyl)-4-[[ethoxy(sulfanylidene)methyl]thio]pentanoic acid methyl ester IUPAC Name: methyl 5-(1,3-dioxoisoindol-2-yl)-4-ethoxycarbothioylsulfanylpentanoate Traditional Name: 4-(ethoxycarbothioylthio)-5-phthalimido-valeric acid methyl ester Formula: C17H19NO5S2 MolecularWeight: 381.46646

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=S)SC(CCC(=O)OC)CN1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

CCOC(=S)SC(CCC(=O)OC)CN1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C17H19NO5S2/c1-3-23-17(24)25-11(8-9-14(19)22-2)10-18-15(20)12-6-4-5-7-13(12)16(18)21/h4-7,11H,3,8-10H2,1-2H3