N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-thiophen-2-yl-quinoline-4-carboxamide

Systemtic Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-(2-thienyl)quinoline-4-carboxamide CAS Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-(2-thienyl)cinchoninamide Formula: C28H19N3OS2 MolecularWeight: 477.59996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=CS6

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=CS6

InChI

InChI=1S/C28H19N3OS2/c1-17-8-13-23-26(15-17)34-28(31-23)18-9-11-19(12-10-18)29-27(32)21-16-24(25-7-4-14-33-25)30-22-6-3-2-5-20(21)22/h2-16H,1H3,(H,29,32)