6-azanyl-1-(2-methylpropyl)-5-[(S)-(5-methylthiophen-2-yl)-morpholin-4-ium-4-yl-methyl]pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-1-(2-methylpropyl)-5-[(S)-(5-methylthiophen-2-yl)-morpholin-4-ium-4-yl-methyl]pyrimidine-2,4-dione Openeye Name: 6-amino-1-isobutyl-5-[(S)-(5-methyl-2-thienyl)-morpholin-4-ium-4-yl-methyl]pyrimidine-2,4-dione CAS Name: 6-amino-1-(2-methylpropyl)-5-[(S)-(5-methyl-2-thiophenyl)-(4-morpholin-4-iumyl)methyl]pyrimidine-2,4-dione IUPAC Name: 6-amino-1-(2-methylpropyl)-5-[(S)-(5-methylthiophen-2-yl)-morpholin-4-ium-4-ylmethyl]pyrimidine-2,4-dione Traditional Name: 6-amino-1-isobutyl-5-[(S)-(5-methyl-2-thienyl)-morpholin-4-ium-4-yl-methyl]pyrimidine-2,4-quinone Formula: C18H27N4O3S+ MolecularWeight: 379.49698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(C2=C(N(C(=O)NC2=O)CC(C)C)N)[NH+]3CCOCC3

Isomeric SMILES

CC1=CC=C(S1)[C@H](C2=C(N(C(=O)NC2=O)CC(C)C)N)[NH+]3CCOCC3

InChI

InChI=1S/C18H26N4O3S/c1-11(2)10-22-16(19)14(17(23)20-18(22)24)15(13-5-4-12(3)26-13)21-6-8-25-9-7-21/h4-5,11,15H,6-10,19H2,1-3H3,(H,20,23,24)/p+1/t15-/m1/s1