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

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propanamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(1-phenyltetrazol-5-yl)sulfanyl-propanamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-[(1-phenyl-5-tetrazolyl)thio]propanamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(1-phenyltetrazol-5-yl)sulfanylpropanamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-[(1-phenyltetrazol-5-yl)thio]propionamide Formula: C19H18N6O2S2 MolecularWeight: 426.51522

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CCSC3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CCSC3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C19H18N6O2S2/c1-2-27-14-8-9-15-16(12-14)29-18(20-15)21-17(26)10-11-28-19-22-23-24-25(19)13-6-4-3-5-7-13/h3-9,12H,2,10-11H2,1H3,(H,20,21,26)