3-(3-fluoranyl-4-methoxy-phenyl)-N-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: 3-(3-fluoranyl-4-methoxy-phenyl)-N-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propanamide Openeye Name: 3-(3-fluoro-4-methoxy-phenyl)-N-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-(3-fluoro-4-methoxyphenyl)-N-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-(3-fluoro-4-methoxyphenyl)-N-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-(3-fluoro-4-methoxy-phenyl)-N-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propionamide Formula: C18H21FN2O2S MolecularWeight: 348.434943

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=N2)NC(=O)CCC3=CC(=C(C=C3)OC)F

Isomeric SMILES

CC1CCC2=C(C1)SC(=N2)NC(=O)CCC3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C18H21FN2O2S/c1-11-3-6-14-16(9-11)24-18(20-14)21-17(22)8-5-12-4-7-15(23-2)13(19)10-12/h4,7,10-11H,3,5-6,8-9H2,1-2H3,(H,20,21,22)