2-[[(3-fluorophenyl)carbamoyl-propan-2-yl-amino]methyl]-N-propan-2-yl-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[[(3-fluorophenyl)carbamoyl-propan-2-yl-amino]methyl]-N-propan-2-yl-1,3-thiazole-4-carboxamide Openeye Name: 2-[[(3-fluorophenyl)carbamoyl-isopropyl-amino]methyl]-N-isopropyl-thiazole-4-carboxamide CAS Name: 2-[[[(3-fluoroanilino)-oxomethyl]-propan-2-ylamino]methyl]-N-propan-2-yl-4-thiazolecarboxamide IUPAC Name: 2-[[(3-fluorophenyl)carbamoyl-propan-2-ylamino]methyl]-N-propan-2-yl-1,3-thiazole-4-carboxamide Traditional Name: 2-[[(3-fluorophenyl)carbamoyl-isopropyl-amino]methyl]-N-isopropyl-thiazole-4-carboxamide Formula: C18H23FN4O2S MolecularWeight: 378.464223

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CSC(=N1)CN(C(C)C)C(=O)NC2=CC(=CC=C2)F

Isomeric SMILES

CC(C)NC(=O)C1=CSC(=N1)CN(C(C)C)C(=O)NC2=CC(=CC=C2)F

InChI

InChI=1S/C18H23FN4O2S/c1-11(2)20-17(24)15-10-26-16(22-15)9-23(12(3)4)18(25)21-14-7-5-6-13(19)8-14/h5-8,10-12H,9H2,1-4H3,(H,20,24)(H,21,25)