N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(3-imidazol-1-ylpropyl)-3-thiophen-2-yl-prop-2-enamide

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(3-imidazol-1-ylpropyl)-3-thiophen-2-yl-prop-2-enamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(3-imidazol-1-ylpropyl)-3-(2-thienyl)prop-2-enamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-[3-(1-imidazolyl)propyl]-3-thiophen-2-yl-2-propenamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(3-imidazol-1-ylpropyl)-3-thiophen-2-ylprop-2-enamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(3-imidazol-1-ylpropyl)-3-(2-thienyl)acrylamide Formula: C22H22N4O2S2 MolecularWeight: 438.56568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)N(CCCN3C=CN=C3)C(=O)C=CC4=CC=CS4

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)N(CCCN3C=CN=C3)C(=O)C=CC4=CC=CS4

InChI

InChI=1S/C22H22N4O2S2/c1-2-28-17-6-8-19-20(15-17)30-22(24-19)26(12-4-11-25-13-10-23-16-25)21(27)9-7-18-5-3-14-29-18/h3,5-10,13-16H,2,4,11-12H2,1H3