N-(1,3-benzothiazol-2-yl)-2-methyl-4-(1-methylpyrazol-4-yl)-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-methyl-4-(1-methylpyrazol-4-yl)-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-methyl-4-(1-methylpyrazol-4-yl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-methyl-4-(1-methyl-4-pyrazolyl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-methyl-4-(1-methylpyrazol-4-yl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-5-keto-2-methyl-4-(1-methylpyrazol-4-yl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide Formula: C22H21N5O2S MolecularWeight: 419.49944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)CCCC2=O)C3=CN(N=C3)C)C(=O)NC4=NC5=CC=CC=C5S4

Isomeric SMILES

CC1=C(C(C2=C(N1)CCCC2=O)C3=CN(N=C3)C)C(=O)NC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H21N5O2S/c1-12-18(21(29)26-22-25-14-6-3-4-9-17(14)30-22)19(13-10-23-27(2)11-13)20-15(24-12)7-5-8-16(20)28/h3-4,6,9-11,19,24H,5,7-8H2,1-2H3,(H,25,26,29)