N-[2-(dimethylamino)-2-thiophen-3-yl-ethyl]-2-propan-2-yl-quinoline-4-carboxamide

Systemtic Name: N-[2-(dimethylamino)-2-thiophen-3-yl-ethyl]-2-propan-2-yl-quinoline-4-carboxamide Openeye Name: N-[2-(dimethylamino)-2-(3-thienyl)ethyl]-2-isopropyl-quinoline-4-carboxamide CAS Name: N-[2-(dimethylamino)-2-(3-thiophenyl)ethyl]-2-propan-2-yl-4-quinolinecarboxamide IUPAC Name: N-[2-(dimethylamino)-2-thiophen-3-ylethyl]-2-propan-2-ylquinoline-4-carboxamide Traditional Name: N-[2-(dimethylamino)-2-(3-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=CSC=C3)N(C)C

Isomeric SMILES

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

InChI

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