O-propan-2-yl [2-(5-nitro-2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanylmethanethioate

Systemtic Name: O-propan-2-yl [2-(5-nitro-2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanylmethanethioate Openeye Name: O-isopropyl [2-(5-nitroindolin-1-yl)-2-oxo-ethyl]sulfanylmethanethioate CAS Name: [[2-(5-nitro-2,3-dihydroindol-1-yl)-2-oxoethyl]thio]methanethioic acid O-propan-2-yl ester IUPAC Name: O-propan-2-yl [2-(5-nitro-2,3-dihydroindol-1-yl)-2-oxoethyl]sulfanylmethanethioate Traditional Name: [[2-keto-2-(5-nitroindolin-1-yl)ethyl]thio]methanethioic acid O-isopropyl ester Formula: C14H16N2O4S2 MolecularWeight: 340.41784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=S)SCC(=O)N1CCC2=C1C=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)OC(=S)SCC(=O)N1CCC2=C1C=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H16N2O4S2/c1-9(2)20-14(21)22-8-13(17)15-6-5-10-7-11(16(18)19)3-4-12(10)15/h3-4,7,9H,5-6,8H2,1-2H3