N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-(5-methylthiophen-2-yl)quinoline-4-carboxamide

Systemtic Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-(5-methylthiophen-2-yl)quinoline-4-carboxamide Openeye Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-(5-methyl-2-thienyl)quinoline-4-carboxamide CAS Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-(5-methyl-2-thiophenyl)-4-quinolinecarboxamide IUPAC Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-(5-methylthiophen-2-yl)quinoline-4-carboxamide Traditional Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-(5-methyl-2-thienyl)cinchoninamide Formula: C29H21N3OS2 MolecularWeight: 491.62654

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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=C(S6)C

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=C(S6)C

InChI

InChI=1S/C29H21N3OS2/c1-17-7-13-24-27(15-17)35-29(32-24)19-9-11-20(12-10-19)30-28(33)22-16-25(26-14-8-18(2)34-26)31-23-6-4-3-5-21(22)23/h3-16H,1-2H3,(H,30,33)