N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-2-cyclopropyl-N-methyl-quinoline-4-carboxamide

Systemtic Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-2-cyclopropyl-N-methyl-quinoline-4-carboxamide Openeye Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-2-cyclopropyl-N-methyl-quinoline-4-carboxamide CAS Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-2-cyclopropyl-N-methyl-4-quinolinecarboxamide IUPAC Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-2-cyclopropyl-N-methylquinoline-4-carboxamide Traditional Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-2-cyclopropyl-N-methyl-cinchoninamide Formula: C23H21N3OS MolecularWeight: 387.49734

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2S1)N(C)C(=O)C3=CC(=NC4=CC=CC=C43)C5CC5

Isomeric SMILES

C[C@H](C1=NC2=CC=CC=C2S1)N(C)C(=O)C3=CC(=NC4=CC=CC=C43)C5CC5

InChI

InChI=1S/C23H21N3OS/c1-14(22-25-19-9-5-6-10-21(19)28-22)26(2)23(27)17-13-20(15-11-12-15)24-18-8-4-3-7-16(17)18/h3-10,13-15H,11-12H2,1-2H3/t14-/m1/s1