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

Systemtic Name: N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-(3-fluoranyl-4-methoxy-phenyl)propanamide Openeye Name: N-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-3-(3-fluoro-4-methoxy-phenyl)propanamide CAS Name: N-[4-(3,4-dimethoxyphenyl)-2-thiazolyl]-3-(3-fluoro-4-methoxyphenyl)propanamide IUPAC Name: N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-(3-fluoro-4-methoxyphenyl)propanamide Traditional Name: N-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-3-(3-fluoro-4-methoxy-phenyl)propionamide Formula: C21H21FN2O4S MolecularWeight: 416.465843

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)CCC3=CC(=C(C=C3)OC)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)CCC3=CC(=C(C=C3)OC)F)OC

InChI

InChI=1S/C21H21FN2O4S/c1-26-17-7-4-13(10-15(17)22)5-9-20(25)24-21-23-16(12-29-21)14-6-8-18(27-2)19(11-14)28-3/h4,6-8,10-12H,5,9H2,1-3H3,(H,23,24,25)