5-(2-diethylaminoethylcarbamoylamino)-3-(pyridin-3-ylmethoxy)-1,2-thiazole-4-carboxamide

Systemtic Name: 5-(2-diethylaminoethylcarbamoylamino)-3-(pyridin-3-ylmethoxy)-1,2-thiazole-4-carboxamide Openeye Name: 5-(2-diethylaminoethylcarbamoylamino)-3-(3-pyridylmethoxy)isothiazole-4-carboxamide CAS Name: 5-[[(2-diethylaminoethylamino)-oxomethyl]amino]-3-(3-pyridinylmethoxy)-4-isothiazolecarboxamide IUPAC Name: 5-(2-diethylaminoethylcarbamoylamino)-3-(pyridin-3-ylmethoxy)-1,2-thiazole-4-carboxamide Traditional Name: 5-(2-diethylaminoethylcarbamoylamino)-3-(3-pyridylmethoxy)isothiazole-4-carboxamide Formula: C17H24N6O3S MolecularWeight: 392.47586

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)NC1=C(C(=NS1)OCC2=CN=CC=C2)C(=O)N

Isomeric SMILES

CCN(CC)CCNC(=O)NC1=C(C(=NS1)OCC2=CN=CC=C2)C(=O)N

InChI

InChI=1S/C17H24N6O3S/c1-3-23(4-2)9-8-20-17(25)21-16-13(14(18)24)15(22-27-16)26-11-12-6-5-7-19-10-12/h5-7,10H,3-4,8-9,11H2,1-2H3,(H2,18,24)(H2,20,21,25)