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

Systemtic Name: 2-[[(2-fluorophenyl)carbamoyl-propan-2-yl-amino]methyl]-N-(pyridin-3-ylmethyl)-1,3-thiazole-4-carboxamide Openeye Name: 2-[[(2-fluorophenyl)carbamoyl-isopropyl-amino]methyl]-N-(3-pyridylmethyl)thiazole-4-carboxamide CAS Name: 2-[[[(2-fluoroanilino)-oxomethyl]-propan-2-ylamino]methyl]-N-(3-pyridinylmethyl)-4-thiazolecarboxamide IUPAC Name: 2-[[(2-fluorophenyl)carbamoyl-propan-2-ylamino]methyl]-N-(pyridin-3-ylmethyl)-1,3-thiazole-4-carboxamide Traditional Name: 2-[[(2-fluorophenyl)carbamoyl-isopropyl-amino]methyl]-N-(3-pyridylmethyl)thiazole-4-carboxamide Formula: C21H22FN5O2S MolecularWeight: 427.495083

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=NC(=CS1)C(=O)NCC2=CN=CC=C2)C(=O)NC3=CC=CC=C3F

Isomeric SMILES

CC(C)N(CC1=NC(=CS1)C(=O)NCC2=CN=CC=C2)C(=O)NC3=CC=CC=C3F

InChI

InChI=1S/C21H22FN5O2S/c1-14(2)27(21(29)26-17-8-4-3-7-16(17)22)12-19-25-18(13-30-19)20(28)24-11-15-6-5-9-23-10-15/h3-10,13-14H,11-12H2,1-2H3,(H,24,28)(H,26,29)