N-(3-fluoranyl-4-methyl-phenyl)-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]propanamide

Systemtic Name: N-(3-fluoranyl-4-methyl-phenyl)-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]propanamide Openeye Name: N-(3-fluoro-4-methyl-phenyl)-2-[(1-phenyltetrazol-5-yl)methylsulfanyl]propanamide CAS Name: N-(3-fluoro-4-methylphenyl)-2-[(1-phenyl-5-tetrazolyl)methylthio]propanamide IUPAC Name: N-(3-fluoro-4-methylphenyl)-2-[(1-phenyltetrazol-5-yl)methylsulfanyl]propanamide Traditional Name: N-(3-fluoro-4-methyl-phenyl)-2-[(1-phenyltetrazol-5-yl)methylthio]propionamide Formula: C18H18FN5OS MolecularWeight: 371.431823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)SCC2=NN=NN2C3=CC=CC=C3)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C)SCC2=NN=NN2C3=CC=CC=C3)F

InChI

InChI=1S/C18H18FN5OS/c1-12-8-9-14(10-16(12)19)20-18(25)13(2)26-11-17-21-22-23-24(17)15-6-4-3-5-7-15/h3-10,13H,11H2,1-2H3,(H,20,25)