N-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methyl]-3-(3-fluoranyl-4-methoxy-phenyl)propanamide

Systemtic Name: N-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methyl]-3-(3-fluoranyl-4-methoxy-phenyl)propanamide Openeye Name: N-[[5-(1,3-benzothiazol-2-yl)-2-furyl]methyl]-3-(3-fluoro-4-methoxy-phenyl)propanamide CAS Name: N-[[5-(1,3-benzothiazol-2-yl)-2-furanyl]methyl]-3-(3-fluoro-4-methoxyphenyl)propanamide IUPAC Name: N-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methyl]-3-(3-fluoro-4-methoxyphenyl)propanamide Traditional Name: N-[[5-(1,3-benzothiazol-2-yl)-2-furyl]methyl]-3-(3-fluoro-4-methoxy-phenyl)propionamide Formula: C22H19FN2O3S MolecularWeight: 410.461263

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=O)NCC2=CC=C(O2)C3=NC4=CC=CC=C4S3)F

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=O)NCC2=CC=C(O2)C3=NC4=CC=CC=C4S3)F

InChI

InChI=1S/C22H19FN2O3S/c1-27-18-9-6-14(12-16(18)23)7-11-21(26)24-13-15-8-10-19(28-15)22-25-17-4-2-3-5-20(17)29-22/h2-6,8-10,12H,7,11,13H2,1H3,(H,24,26)