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

Systemtic Name: N-cyclohexyl-2-[[(2-fluorophenyl)carbamoyl-propan-2-yl-amino]methyl]-1,3-thiazole-4-carboxamide Openeye Name: N-cyclohexyl-2-[[(2-fluorophenyl)carbamoyl-isopropyl-amino]methyl]thiazole-4-carboxamide CAS Name: N-cyclohexyl-2-[[[(2-fluoroanilino)-oxomethyl]-propan-2-ylamino]methyl]-4-thiazolecarboxamide IUPAC Name: N-cyclohexyl-2-[[(2-fluorophenyl)carbamoyl-propan-2-ylamino]methyl]-1,3-thiazole-4-carboxamide Traditional Name: N-cyclohexyl-2-[[(2-fluorophenyl)carbamoyl-isopropyl-amino]methyl]thiazole-4-carboxamide Formula: C21H27FN4O2S MolecularWeight: 418.528083

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=NC(=CS1)C(=O)NC2CCCCC2)C(=O)NC3=CC=CC=C3F

Isomeric SMILES

CC(C)N(CC1=NC(=CS1)C(=O)NC2CCCCC2)C(=O)NC3=CC=CC=C3F

InChI

InChI=1S/C21H27FN4O2S/c1-14(2)26(21(28)25-17-11-7-6-10-16(17)22)12-19-24-18(13-29-19)20(27)23-15-8-4-3-5-9-15/h6-7,10-11,13-15H,3-5,8-9,12H2,1-2H3,(H,23,27)(H,25,28)