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

Systemtic Name: N-[2-(4,6-dimethyl-2-oxidanylidene-pyrimidin-1-yl)ethyl]-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Openeye Name: N-[2-(4,6-dimethyl-2-oxo-pyrimidin-1-yl)ethyl]-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide CAS Name: N-[2-(4,6-dimethyl-2-oxo-1-pyrimidinyl)ethyl]-5-[(2R)-2-pyrrolidin-1-iumyl]-2-thiophenecarboxamide IUPAC Name: N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Traditional Name: N-[2-(2-keto-4,6-dimethyl-pyrimidin-1-yl)ethyl]-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Formula: C17H23N4O2S+ MolecularWeight: 347.45512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=O)N1CCNC(=O)C2=CC=C(S2)C3CCC[NH2+]3)C

Isomeric SMILES

CC1=CC(=NC(=O)N1CCNC(=O)C2=CC=C(S2)[C@H]3CCC[NH2+]3)C

InChI

InChI=1S/C17H22N4O2S/c1-11-10-12(2)21(17(23)20-11)9-8-19-16(22)15-6-5-14(24-15)13-4-3-7-18-13/h5-6,10,13,18H,3-4,7-9H2,1-2H3,(H,19,22)/p+1/t13-/m1/s1