[2-[(2-fluorophenyl)carbamoylamino]-2-oxidanylidene-ethyl] 2-(3-methylbutylamino)-1,3-thiazole-4-carboxylate

Systemtic Name: [2-[(2-fluorophenyl)carbamoylamino]-2-oxidanylidene-ethyl] 2-(3-methylbutylamino)-1,3-thiazole-4-carboxylate Openeye Name: [2-[(2-fluorophenyl)carbamoylamino]-2-oxo-ethyl] 2-(isopentylamino)thiazole-4-carboxylate CAS Name: 2-(3-methylbutylamino)-4-thiazolecarboxylic acid [2-[[(2-fluoroanilino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[(2-fluorophenyl)carbamoylamino]-2-oxoethyl] 2-(3-methylbutylamino)-1,3-thiazole-4-carboxylate Traditional Name: 2-(isoamylamino)thiazole-4-carboxylic acid [2-[(2-fluorophenyl)carbamoylamino]-2-keto-ethyl] ester Formula: C18H21FN4O4S MolecularWeight: 408.447143

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=NC(=CS1)C(=O)OCC(=O)NC(=O)NC2=CC=CC=C2F

Isomeric SMILES

CC(C)CCNC1=NC(=CS1)C(=O)OCC(=O)NC(=O)NC2=CC=CC=C2F

InChI

InChI=1S/C18H21FN4O4S/c1-11(2)7-8-20-18-22-14(10-28-18)16(25)27-9-15(24)23-17(26)21-13-6-4-3-5-12(13)19/h3-6,10-11H,7-9H2,1-2H3,(H,20,22)(H2,21,23,24,26)