N-[(5-chloranylthiophen-2-yl)methyl]-1-(6-fluoranyl-4-methyl-quinazolin-2-yl)azepan-4-amine

Systemtic Name: N-[(5-chloranylthiophen-2-yl)methyl]-1-(6-fluoranyl-4-methyl-quinazolin-2-yl)azepan-4-amine Openeye Name: N-[(5-chloro-2-thienyl)methyl]-1-(6-fluoro-4-methyl-quinazolin-2-yl)azepan-4-amine CAS Name: N-[(5-chloro-2-thiophenyl)methyl]-1-(6-fluoro-4-methyl-2-quinazolinyl)-4-azepanamine IUPAC Name: N-[(5-chlorothiophen-2-yl)methyl]-1-(6-fluoro-4-methylquinazolin-2-yl)azepan-4-amine Traditional Name: (5-chloro-2-thienyl)methyl-[1-(6-fluoro-4-methyl-quinazolin-2-yl)azepan-4-yl]amine Formula: C20H22ClFN4S MolecularWeight: 404.931883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=C1C=C(C=C2)F)N3CCCC(CC3)NCC4=CC=C(S4)Cl

Isomeric SMILES

CC1=NC(=NC2=C1C=C(C=C2)F)N3CCCC(CC3)NCC4=CC=C(S4)Cl

InChI

InChI=1S/C20H22ClFN4S/c1-13-17-11-14(22)4-6-18(17)25-20(24-13)26-9-2-3-15(8-10-26)23-12-16-5-7-19(21)27-16/h4-7,11,15,23H,2-3,8-10,12H2,1H3