N-[(1S)-2-methyl-1-thiophen-2-yl-propyl]-4-(2H-1,2,3,4-tetrazol-5-yl)benzenecarboximidate

Systemtic Name: N-[(1S)-2-methyl-1-thiophen-2-yl-propyl]-4-(2H-1,2,3,4-tetrazol-5-yl)benzenecarboximidate Openeye Name: N-[(1S)-2-methyl-1-(2-thienyl)propyl]-4-(2H-tetrazol-5-yl)benzenecarboximidate CAS Name: N-[(1S)-2-methyl-1-thiophen-2-ylpropyl]-4-(2H-tetrazol-5-yl)benzenecarboximidate IUPAC Name: N-[(1S)-2-methyl-1-thiophen-2-ylpropyl]-4-(2H-tetrazol-5-yl)benzenecarboximidate Traditional Name: N-[(1S)-2-methyl-1-(2-thienyl)propyl]-4-(2H-tetrazol-5-yl)benzenecarboximidate Formula: C16H16N5OS- MolecularWeight: 326.39614

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=CS1)N=C(C2=CC=C(C=C2)C3=NNN=N3)[O-]

Isomeric SMILES

CC(C)[C@@H](C1=CC=CS1)N=C(C2=CC=C(C=C2)C3=NNN=N3)[O-]

InChI

InChI=1S/C16H17N5OS/c1-10(2)14(13-4-3-9-23-13)17-16(22)12-7-5-11(6-8-12)15-18-20-21-19-15/h3-10,14H,1-2H3,(H,17,22)(H,18,19,20,21)/p-1/t14-/m0/s1