N-(6-acetamido-1,3-benzothiazol-2-yl)-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamide

Systemtic Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamide Openeye Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-(1-phenyltetrazol-5-yl)sulfanyl-acetamide CAS Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-[(1-phenyl-5-tetrazolyl)thio]acetamide IUPAC Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-(1-phenyltetrazol-5-yl)sulfanylacetamide Traditional Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-[(1-phenyltetrazol-5-yl)thio]acetamide Formula: C18H15N7O2S2 MolecularWeight: 425.4874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C18H15N7O2S2/c1-11(26)19-12-7-8-14-15(9-12)29-17(20-14)21-16(27)10-28-18-22-23-24-25(18)13-5-3-2-4-6-13/h2-9H,10H2,1H3,(H,19,26)(H,20,21,27)