1-ethyl-5-[2-(methoxycarbamoylamino)pyrimidin-4-yl]oxy-indol-1-ium-1-carboxamide

Systemtic Name: 1-ethyl-5-[2-(methoxycarbamoylamino)pyrimidin-4-yl]oxy-indol-1-ium-1-carboxamide Openeye Name: 1-ethyl-5-[2-(methoxycarbamoylamino)pyrimidin-4-yl]oxy-indol-1-ium-1-carboxamide CAS Name: 1-ethyl-5-[[2-[[(methoxyamino)-oxomethyl]amino]-4-pyrimidinyl]oxy]-1-indol-1-iumcarboxamide IUPAC Name: 1-ethyl-5-[2-(methoxycarbamoylamino)pyrimidin-4-yl]oxyindol-1-ium-1-carboxamide Traditional Name: 1-ethyl-5-[2-(methoxycarbamoylamino)pyrimidin-4-yl]oxy-indol-1-ium-1-carboxamide Formula: C17H19N6O4+ MolecularWeight: 371.37056

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(C=CC2=C1C=CC(=C2)OC3=NC(=NC=C3)NC(=O)NOC)C(=O)N

Isomeric SMILES

CC[N+]1(C=CC2=C1C=CC(=C2)OC3=NC(=NC=C3)NC(=O)NOC)C(=O)N

InChI

InChI=1S/C17H18N6O4/c1-3-23(15(18)24)9-7-11-10-12(4-5-13(11)23)27-14-6-8-19-16(20-14)21-17(25)22-26-2/h4-10H,3H2,1-2H3,(H3-,18,19,20,21,22,24,25)/p+1