4-(5-methylfuran-2-yl)carbonyl-1-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-5-pyridin-1-ium-3-yl-pyrrolidine-2,3-dione

Systemtic Name: 4-(5-methylfuran-2-yl)carbonyl-1-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-5-pyridin-1-ium-3-yl-pyrrolidine-2,3-dione Openeye Name: 1-(5-isopropyl-1,3,4-thiadiazol-2-yl)-4-(5-methylfuran-2-carbonyl)-5-pyridin-1-ium-3-yl-pyrrolidine-2,3-dione CAS Name: 4-[(5-methyl-2-furanyl)-oxomethyl]-1-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-5-(3-pyridin-1-iumyl)pyrrolidine-2,3-dione IUPAC Name: 4-(5-methylfuran-2-carbonyl)-1-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-5-pyridin-1-ium-3-ylpyrrolidine-2,3-dione Traditional Name: 1-(5-isopropyl-1,3,4-thiadiazol-2-yl)-4-(5-methyl-2-furoyl)-5-pyridin-1-ium-3-yl-pyrrolidine-2,3-quinone Formula: C20H19N4O4S+ MolecularWeight: 411.45426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C(=O)C2C(N(C(=O)C2=O)C3=NN=C(S3)C(C)C)C4=C[NH+]=CC=C4

Isomeric SMILES

CC1=CC=C(O1)C(=O)C2C(N(C(=O)C2=O)C3=NN=C(S3)C(C)C)C4=C[NH+]=CC=C4

InChI

InChI=1S/C20H18N4O4S/c1-10(2)18-22-23-20(29-18)24-15(12-5-4-8-21-9-12)14(17(26)19(24)27)16(25)13-7-6-11(3)28-13/h4-10,14-15H,1-3H3/p+1