N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-propan-2-yl-quinoline-4-carboxamide

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-propan-2-yl-quinoline-4-carboxamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-isopropyl-quinoline-4-carboxamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-propan-2-yl-4-quinolinecarboxamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-propan-2-ylquinoline-4-carboxamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-isopropyl-cinchoninamide Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=NC4=CC=CC=C43)C(C)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=NC4=CC=CC=C43)C(C)C

InChI

InChI=1S/C22H21N3O2S/c1-4-27-14-9-10-18-20(11-14)28-22(24-18)25-21(26)16-12-19(13(2)3)23-17-8-6-5-7-15(16)17/h5-13H,4H2,1-3H3,(H,24,25,26)