N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-2-methyl-quinoline-4-carboxamide

Systemtic Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-2-methyl-quinoline-4-carboxamide Openeye Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-thiazol-2-yl]-2-methyl-quinoline-4-carboxamide CAS Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-thiazolyl]-2-methyl-4-quinolinecarboxamide IUPAC Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-2-methylquinoline-4-carboxamide Traditional Name: 2-methyl-N-(4-methyl-5-piperonyl-thiazol-2-yl)cinchoninamide Formula: C23H19N3O3S MolecularWeight: 417.48026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)C(=O)NC3=NC(=C(S3)CC4=CC5=C(C=C4)OCO5)C

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)C(=O)NC3=NC(=C(S3)CC4=CC5=C(C=C4)OCO5)C

InChI

InChI=1S/C23H19N3O3S/c1-13-9-17(16-5-3-4-6-18(16)24-13)22(27)26-23-25-14(2)21(30-23)11-15-7-8-19-20(10-15)29-12-28-19/h3-10H,11-12H2,1-2H3,(H,25,26,27)