N-(4-bromophenyl)-2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]butanamide

Systemtic Name: N-(4-bromophenyl)-2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]butanamide Openeye Name: N-(4-bromophenyl)-2-(1-methyltetrazol-5-yl)sulfanyl-butanamide CAS Name: N-(4-bromophenyl)-2-[(1-methyl-5-tetrazolyl)thio]butanamide IUPAC Name: N-(4-bromophenyl)-2-(1-methyltetrazol-5-yl)sulfanylbutanamide Traditional Name: N-(4-bromophenyl)-2-[(1-methyltetrazol-5-yl)thio]butyramide Formula: C12H14BrN5OS MolecularWeight: 356.24146

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)Br)SC2=NN=NN2C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)Br)SC2=NN=NN2C

InChI

InChI=1S/C12H14BrN5OS/c1-3-10(20-12-15-16-17-18(12)2)11(19)14-9-6-4-8(13)5-7-9/h4-7,10H,3H2,1-2H3,(H,14,19)