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

Systemtic Name: N-[3-aminocarbonyl-5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-thiophen-2-yl]-2-phenyl-quinoline-4-carboxamide Openeye Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-carbamoyl-4-methyl-2-thienyl]-2-phenyl-quinoline-4-carboxamide CAS Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-carbamoyl-4-methyl-2-thiophenyl]-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-carbamoyl-4-methylthiophen-2-yl]-2-phenylquinoline-4-carboxamide Traditional Name: N-(3-carbamoyl-4-methyl-5-piperonyl-2-thienyl)-2-phenyl-cinchoninamide Formula: C30H23N3O4S MolecularWeight: 521.58632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4)CC5=CC6=C(C=C5)OCO6

Isomeric SMILES

CC1=C(SC(=C1C(=O)N)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4)CC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C30H23N3O4S/c1-17-26(14-18-11-12-24-25(13-18)37-16-36-24)38-30(27(17)28(31)34)33-29(35)21-15-23(19-7-3-2-4-8-19)32-22-10-6-5-9-20(21)22/h2-13,15H,14,16H2,1H3,(H2,31,34)(H,33,35)