N-(6-butyl-1,3-benzothiazol-2-yl)-2-(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)ethanamide

Systemtic Name: N-(6-butyl-1,3-benzothiazol-2-yl)-2-(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)ethanamide Openeye Name: N-(6-butyl-1,3-benzothiazol-2-yl)-2-[5-oxo-4-(2-thienyl)tetrazol-1-yl]acetamide CAS Name: N-(6-butyl-1,3-benzothiazol-2-yl)-2-(5-oxo-4-thiophen-2-yl-1-tetrazolyl)acetamide IUPAC Name: N-(6-butyl-1,3-benzothiazol-2-yl)-2-(5-oxo-4-thiophen-2-yltetrazol-1-yl)acetamide Traditional Name: N-(6-butyl-1,3-benzothiazol-2-yl)-2-[5-keto-4-(2-thienyl)tetrazol-1-yl]acetamide Formula: C18H18N6O2S2 MolecularWeight: 414.50452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=O)CN3C(=O)N(N=N3)C4=CC=CS4

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=O)CN3C(=O)N(N=N3)C4=CC=CS4

InChI

InChI=1S/C18H18N6O2S2/c1-2-3-5-12-7-8-13-14(10-12)28-17(19-13)20-15(25)11-23-18(26)24(22-21-23)16-6-4-9-27-16/h4,6-10H,2-3,5,11H2,1H3,(H,19,20,25)