N-[2-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)ethyl]-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[2-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)ethyl]-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Openeye Name: N-[2-(6-methyl-4-oxo-1H-pyrimidin-2-yl)ethyl]-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide CAS Name: N-[2-(6-methyl-4-oxo-1H-pyrimidin-2-yl)ethyl]-5-[(2R)-2-pyrrolidin-1-iumyl]-2-thiophenecarboxamide IUPAC Name: N-[2-(6-methyl-4-oxo-1H-pyrimidin-2-yl)ethyl]-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Traditional Name: N-[2-(4-keto-6-methyl-1H-pyrimidin-2-yl)ethyl]-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Formula: C16H21N4O2S+ MolecularWeight: 333.42854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)CCNC(=O)C2=CC=C(S2)C3CCC[NH2+]3

Isomeric SMILES

CC1=CC(=O)N=C(N1)CCNC(=O)C2=CC=C(S2)[C@H]3CCC[NH2+]3

InChI

InChI=1S/C16H20N4O2S/c1-10-9-15(21)20-14(19-10)6-8-18-16(22)13-5-4-12(23-13)11-3-2-7-17-11/h4-5,9,11,17H,2-3,6-8H2,1H3,(H,18,22)(H,19,20,21)/p+1/t11-/m1/s1