N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-3-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]propanamide

Systemtic Name: N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-3-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]propanamide Openeye Name: N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-3-(4-nitro-1,3-dioxo-isoindolin-2-yl)propanamide CAS Name: N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-3-(4-nitro-1,3-dioxo-2-isoindolyl)propanamide IUPAC Name: N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-3-(4-nitro-1,3-dioxoisoindol-2-yl)propanamide Traditional Name: N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-3-(1,3-diketo-4-nitro-isoindolin-2-yl)propionamide Formula: C19H19N5O5S MolecularWeight: 429.44966

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NN=C(S2)NC(=O)CCN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)C2=NN=C(S2)NC(=O)CCN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H19N5O5S/c25-14(20-19-22-21-16(30-19)11-5-2-1-3-6-11)9-10-23-17(26)12-7-4-8-13(24(28)29)15(12)18(23)27/h4,7-8,11H,1-3,5-6,9-10H2,(H,20,22,25)