6-azanyl-3-methyl-1-(2-methylpropyl)-5-[2-[(2S)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]ethanoyl]pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-3-methyl-1-(2-methylpropyl)-5-[2-[(2S)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]ethanoyl]pyrimidine-2,4-dione Openeye Name: 6-amino-1-isobutyl-3-methyl-5-[2-[(2S)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]acetyl]pyrimidine-2,4-dione CAS Name: 6-amino-3-methyl-1-(2-methylpropyl)-5-[1-oxo-2-[(2S)-2-thiophen-2-yl-1-pyrrolidin-1-iumyl]ethyl]pyrimidine-2,4-dione IUPAC Name: 6-amino-3-methyl-1-(2-methylpropyl)-5-[2-[(2S)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]acetyl]pyrimidine-2,4-dione Traditional Name: 6-amino-1-isobutyl-3-methyl-5-[2-[(2S)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]acetyl]pyrimidine-2,4-quinone Formula: C19H27N4O3S+ MolecularWeight: 391.50768

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=C(C(=O)N(C1=O)C)C(=O)C[NH+]2CCCC2C3=CC=CS3)N

Isomeric SMILES

CC(C)CN1C(=C(C(=O)N(C1=O)C)C(=O)C[NH+]2CCC[C@H]2C3=CC=CS3)N

InChI

InChI=1S/C19H26N4O3S/c1-12(2)10-23-17(20)16(18(25)21(3)19(23)26)14(24)11-22-8-4-6-13(22)15-7-5-9-27-15/h5,7,9,12-13H,4,6,8,10-11,20H2,1-3H3/p+1/t13-/m0/s1