N-[4,5-bis(4-methylphenyl)-1,3-thiazol-2-yl]quinoline-2-carboxamide

Systemtic Name: N-[4,5-bis(4-methylphenyl)-1,3-thiazol-2-yl]quinoline-2-carboxamide Openeye Name: N-[4,5-bis(p-tolyl)thiazol-2-yl]quinoline-2-carboxamide CAS Name: N-[4,5-bis(4-methylphenyl)-2-thiazolyl]-2-quinolinecarboxamide IUPAC Name: N-[4,5-bis(4-methylphenyl)-1,3-thiazol-2-yl]quinoline-2-carboxamide Traditional Name: N-[4,5-bis(p-tolyl)thiazol-2-yl]quinaldamide Formula: C27H21N3OS MolecularWeight: 435.54014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)C3=NC4=CC=CC=C4C=C3)C5=CC=C(C=C5)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)C3=NC4=CC=CC=C4C=C3)C5=CC=C(C=C5)C

InChI

InChI=1S/C27H21N3OS/c1-17-7-11-20(12-8-17)24-25(21-13-9-18(2)10-14-21)32-27(29-24)30-26(31)23-16-15-19-5-3-4-6-22(19)28-23/h3-16H,1-2H3,(H,29,30,31)