N-(2-bromanyl-4-methyl-phenyl)-2-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propanamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-2-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propanamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-2-(1-cyclopropyltetrazol-5-yl)sulfanyl-propanamide CAS Name: N-(2-bromo-4-methylphenyl)-2-[(1-cyclopropyl-5-tetrazolyl)thio]propanamide IUPAC Name: N-(2-bromo-4-methylphenyl)-2-(1-cyclopropyltetrazol-5-yl)sulfanylpropanamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-2-[(1-cyclopropyltetrazol-5-yl)thio]propionamide Formula: C14H16BrN5OS MolecularWeight: 382.27874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(C)SC2=NN=NN2C3CC3)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C(C)SC2=NN=NN2C3CC3)Br

InChI

InChI=1S/C14H16BrN5OS/c1-8-3-6-12(11(15)7-8)16-13(21)9(2)22-14-17-18-19-20(14)10-4-5-10/h3,6-7,9-10H,4-5H2,1-2H3,(H,16,21)