N-[3-(quinolin-2-ylcarbonylamino)propyl]-1,3-benzothiazole-2-carboxamide

Systemtic Name: N-[3-(quinolin-2-ylcarbonylamino)propyl]-1,3-benzothiazole-2-carboxamide Openeye Name: N-[3-(quinoline-2-carbonylamino)propyl]-1,3-benzothiazole-2-carboxamide CAS Name: N-[3-[[oxo(2-quinolinyl)methyl]amino]propyl]-1,3-benzothiazole-2-carboxamide IUPAC Name: N-[3-(quinoline-2-carbonylamino)propyl]-1,3-benzothiazole-2-carboxamide Traditional Name: N-[3-(quinaldoylamino)propyl]-1,3-benzothiazole-2-carboxamide Formula: C21H18N4O2S MolecularWeight: 390.45822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)C(=O)NCCCNC(=O)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)C(=O)NCCCNC(=O)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H18N4O2S/c26-19(17-11-10-14-6-1-2-7-15(14)24-17)22-12-5-13-23-20(27)21-25-16-8-3-4-9-18(16)28-21/h1-4,6-11H,5,12-13H2,(H,22,26)(H,23,27)