5-[(2,5-dimethylphenyl)methylcarbamoylamino]-3-(pyridin-3-ylmethoxy)-1,2-thiazole-4-carboxamide

Systemtic Name: 5-[(2,5-dimethylphenyl)methylcarbamoylamino]-3-(pyridin-3-ylmethoxy)-1,2-thiazole-4-carboxamide Openeye Name: 5-[(2,5-dimethylphenyl)methylcarbamoylamino]-3-(3-pyridylmethoxy)isothiazole-4-carboxamide CAS Name: 5-[[[(2,5-dimethylphenyl)methylamino]-oxomethyl]amino]-3-(3-pyridinylmethoxy)-4-isothiazolecarboxamide IUPAC Name: 5-[(2,5-dimethylphenyl)methylcarbamoylamino]-3-(pyridin-3-ylmethoxy)-1,2-thiazole-4-carboxamide Traditional Name: 5-[(2,5-dimethylbenzyl)carbamoylamino]-3-(3-pyridylmethoxy)isothiazole-4-carboxamide Formula: C20H21N5O3S MolecularWeight: 411.47744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CNC(=O)NC2=C(C(=NS2)OCC3=CN=CC=C3)C(=O)N

Isomeric SMILES

CC1=CC(=C(C=C1)C)CNC(=O)NC2=C(C(=NS2)OCC3=CN=CC=C3)C(=O)N

InChI

InChI=1S/C20H21N5O3S/c1-12-5-6-13(2)15(8-12)10-23-20(27)24-19-16(17(21)26)18(25-29-19)28-11-14-4-3-7-22-9-14/h3-9H,10-11H2,1-2H3,(H2,21,26)(H2,23,24,27)