N-[5-(cyclopropylcarbamoyl)-2-methyl-phenyl]-2-[(4-fluorophenyl)amino]-1,3-thiazole-5-carboxamide

Systemtic Name: N-[5-(cyclopropylcarbamoyl)-2-methyl-phenyl]-2-[(4-fluorophenyl)amino]-1,3-thiazole-5-carboxamide Openeye Name: N-[5-(cyclopropylcarbamoyl)-2-methyl-phenyl]-2-(4-fluoroanilino)thiazole-5-carboxamide CAS Name: N-[5-[(cyclopropylamino)-oxomethyl]-2-methylphenyl]-2-(4-fluoroanilino)-5-thiazolecarboxamide IUPAC Name: N-[5-(cyclopropylcarbamoyl)-2-methylphenyl]-2-(4-fluoroanilino)-1,3-thiazole-5-carboxamide Traditional Name: N-[5-(cyclopropylcarbamoyl)-2-methyl-phenyl]-2-(4-fluoroanilino)thiazole-5-carboxamide Formula: C21H19FN4O2S MolecularWeight: 410.464563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2CC2)NC(=O)C3=CN=C(S3)NC4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2CC2)NC(=O)C3=CN=C(S3)NC4=CC=C(C=C4)F

InChI

InChI=1S/C21H19FN4O2S/c1-12-2-3-13(19(27)24-15-8-9-15)10-17(12)26-20(28)18-11-23-21(29-18)25-16-6-4-14(22)5-7-16/h2-7,10-11,15H,8-9H2,1H3,(H,23,25)(H,24,27)(H,26,28)