N-[4-[4-(3-acetamidopropyl)phenyl]-1,3-thiazol-2-yl]-3-fluoranyl-4-methoxy-benzamide

Systemtic Name: N-[4-[4-(3-acetamidopropyl)phenyl]-1,3-thiazol-2-yl]-3-fluoranyl-4-methoxy-benzamide Openeye Name: N-[4-[4-(3-acetamidopropyl)phenyl]thiazol-2-yl]-3-fluoro-4-methoxy-benzamide CAS Name: N-[4-[4-(3-acetamidopropyl)phenyl]-2-thiazolyl]-3-fluoro-4-methoxybenzamide IUPAC Name: N-[4-[4-(3-acetamidopropyl)phenyl]-1,3-thiazol-2-yl]-3-fluoro-4-methoxybenzamide Traditional Name: N-[4-[4-(3-acetamidopropyl)phenyl]thiazol-2-yl]-3-fluoro-4-methoxy-benzamide Formula: C22H22FN3O3S MolecularWeight: 427.491783

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=C(C=C3)OC)F

Isomeric SMILES

CC(=O)NCCCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C22H22FN3O3S/c1-14(27)24-11-3-4-15-5-7-16(8-6-15)19-13-30-22(25-19)26-21(28)17-9-10-20(29-2)18(23)12-17/h5-10,12-13H,3-4,11H2,1-2H3,(H,24,27)(H,25,26,28)