N-[2-(dimethylamino)-2-thiophen-2-yl-ethyl]-2-propan-2-yl-quinoline-4-carboxamide

Systemtic Name: N-[2-(dimethylamino)-2-thiophen-2-yl-ethyl]-2-propan-2-yl-quinoline-4-carboxamide Openeye Name: N-[2-(dimethylamino)-2-(2-thienyl)ethyl]-2-isopropyl-quinoline-4-carboxamide CAS Name: N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-2-propan-2-yl-4-quinolinecarboxamide IUPAC Name: N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-2-propan-2-ylquinoline-4-carboxamide Traditional Name: N-[2-(dimethylamino)-2-(2-thienyl)ethyl]-2-isopropyl-cinchoninamide Formula: C21H25N3OS MolecularWeight: 367.5077

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=CC=CC=C2C(=C1)C(=O)NCC(C3=CC=CS3)N(C)C

Isomeric SMILES

CC(C)C1=NC2=CC=CC=C2C(=C1)C(=O)NCC(C3=CC=CS3)N(C)C

InChI

InChI=1S/C21H25N3OS/c1-14(2)18-12-16(15-8-5-6-9-17(15)23-18)21(25)22-13-19(24(3)4)20-10-7-11-26-20/h5-12,14,19H,13H2,1-4H3,(H,22,25)