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

Systemtic Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-N,2-dimethyl-quinoline-4-carboxamide Openeye Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-N,2-dimethyl-quinoline-4-carboxamide CAS Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-N,2-dimethyl-4-quinolinecarboxamide IUPAC Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-N,2-dimethylquinoline-4-carboxamide Traditional Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-N,2-dimethyl-cinchoninamide Formula: C21H19N3OS MolecularWeight: 361.46006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)C(=O)N(C)C(C)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)C(=O)N(C)[C@H](C)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H19N3OS/c1-13-12-16(15-8-4-5-9-17(15)22-13)21(25)24(3)14(2)20-23-18-10-6-7-11-19(18)26-20/h4-12,14H,1-3H3/t14-/m1/s1