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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-fluorophenyl)amino]-4-methyl-1,3-thiazole-5-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-fluoroanilino)-4-methyl-thiazole-5-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-fluoroanilino)-4-methyl-5-thiazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-fluoroanilino)-4-methyl-1,3-thiazole-5-carboxamide Traditional Name: 2-(4-fluoroanilino)-4-methyl-N-piperonyl-thiazole-5-carboxamide Formula: C19H16FN3O3S MolecularWeight: 385.412043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC2=CC=C(C=C2)F)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(SC(=N1)NC2=CC=C(C=C2)F)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H16FN3O3S/c1-11-17(27-19(22-11)23-14-5-3-13(20)4-6-14)18(24)21-9-12-2-7-15-16(8-12)26-10-25-15/h2-8H,9-10H2,1H3,(H,21,24)(H,22,23)