azepan-1-yl-[6-chloranyl-2-(2,5-dimethylthiophen-3-yl)quinolin-4-yl]methanone

Systemtic Name: azepan-1-yl-[6-chloranyl-2-(2,5-dimethylthiophen-3-yl)quinolin-4-yl]methanone Openeye Name: azepan-1-yl-[6-chloro-2-(2,5-dimethyl-3-thienyl)-4-quinolyl]methanone CAS Name: 1-azepanyl-[6-chloro-2-(2,5-dimethyl-3-thiophenyl)-4-quinolinyl]methanone IUPAC Name: azepan-1-yl-[6-chloro-2-(2,5-dimethylthiophen-3-yl)quinolin-4-yl]methanone Traditional Name: azepan-1-yl-[6-chloro-2-(2,5-dimethyl-3-thienyl)-4-quinolyl]methanone Formula: C22H23ClN2OS MolecularWeight: 398.94882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C2=NC3=C(C=C(C=C3)Cl)C(=C2)C(=O)N4CCCCCC4

Isomeric SMILES

CC1=CC(=C(S1)C)C2=NC3=C(C=C(C=C3)Cl)C(=C2)C(=O)N4CCCCCC4

InChI

InChI=1S/C22H23ClN2OS/c1-14-11-17(15(2)27-14)21-13-19(18-12-16(23)7-8-20(18)24-21)22(26)25-9-5-3-4-6-10-25/h7-8,11-13H,3-6,9-10H2,1-2H3