N-[3-[(2-phenylquinolin-4-yl)carbonylamino]propyl]-1,3-benzothiazole-2-carboxamide

Systemtic Name: N-[3-[(2-phenylquinolin-4-yl)carbonylamino]propyl]-1,3-benzothiazole-2-carboxamide Openeye Name: N-[3-[(2-phenylquinoline-4-carbonyl)amino]propyl]-1,3-benzothiazole-2-carboxamide CAS Name: N-[3-[[oxo-(2-phenyl-4-quinolinyl)methyl]amino]propyl]-1,3-benzothiazole-2-carboxamide IUPAC Name: N-[3-[(2-phenylquinoline-4-carbonyl)amino]propyl]-1,3-benzothiazole-2-carboxamide Traditional Name: N-[3-[(2-phenylquinoline-4-carbonyl)amino]propyl]-1,3-benzothiazole-2-carboxamide Formula: C27H22N4O2S MolecularWeight: 466.55418

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCCNC(=O)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCCNC(=O)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C27H22N4O2S/c32-25(28-15-8-16-29-26(33)27-31-22-13-6-7-14-24(22)34-27)20-17-23(18-9-2-1-3-10-18)30-21-12-5-4-11-19(20)21/h1-7,9-14,17H,8,15-16H2,(H,28,32)(H,29,33)