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

Systemtic Name: N-(phenylmethyl)-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]butanamide Openeye Name: N-benzyl-2-(1-phenyltetrazol-5-yl)sulfanyl-butanamide CAS Name: N-(phenylmethyl)-2-[(1-phenyl-5-tetrazolyl)thio]butanamide IUPAC Name: N-benzyl-2-(1-phenyltetrazol-5-yl)sulfanylbutanamide Traditional Name: N-benzyl-2-[(1-phenyltetrazol-5-yl)thio]butyramide Formula: C18H19N5OS MolecularWeight: 353.44136

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC1=CC=CC=C1)SC2=NN=NN2C3=CC=CC=C3

Isomeric SMILES

CCC(C(=O)NCC1=CC=CC=C1)SC2=NN=NN2C3=CC=CC=C3

InChI

InChI=1S/C18H19N5OS/c1-2-16(17(24)19-13-14-9-5-3-6-10-14)25-18-20-21-22-23(18)15-11-7-4-8-12-15/h3-12,16H,2,13H2,1H3,(H,19,24)