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

Systemtic Name: 2-[[(2-fluorophenyl)carbamoyl-propan-2-yl-amino]methyl]-N-phenethyl-1,3-thiazole-4-carboxamide Openeye Name: 2-[[(2-fluorophenyl)carbamoyl-isopropyl-amino]methyl]-N-phenethyl-thiazole-4-carboxamide CAS Name: 2-[[[(2-fluoroanilino)-oxomethyl]-propan-2-ylamino]methyl]-N-phenethyl-4-thiazolecarboxamide IUPAC Name: 2-[[(2-fluorophenyl)carbamoyl-propan-2-ylamino]methyl]-N-phenethyl-1,3-thiazole-4-carboxamide Traditional Name: 2-[[(2-fluorophenyl)carbamoyl-isopropyl-amino]methyl]-N-phenethyl-thiazole-4-carboxamide Formula: C23H25FN4O2S MolecularWeight: 440.533603

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=NC(=CS1)C(=O)NCCC2=CC=CC=C2)C(=O)NC3=CC=CC=C3F

Isomeric SMILES

CC(C)N(CC1=NC(=CS1)C(=O)NCCC2=CC=CC=C2)C(=O)NC3=CC=CC=C3F

InChI

InChI=1S/C23H25FN4O2S/c1-16(2)28(23(30)27-19-11-7-6-10-18(19)24)14-21-26-20(15-31-21)22(29)25-13-12-17-8-4-3-5-9-17/h3-11,15-16H,12-14H2,1-2H3,(H,25,29)(H,27,30)