(1S,3S)-N1-(6-fluoranyl-4-methyl-quinolin-2-yl)-N3-(thiophen-3-ylmethyl)cyclohexane-1,3-diamine

Systemtic Name: (1S,3S)-N1-(6-fluoranyl-4-methyl-quinolin-2-yl)-N3-(thiophen-3-ylmethyl)cyclohexane-1,3-diamine Openeye Name: (1S,3S)-N1-(6-fluoro-4-methyl-2-quinolyl)-N3-(3-thienylmethyl)cyclohexane-1,3-diamine CAS Name: (1S,3S)-N1-(6-fluoro-4-methyl-2-quinolinyl)-N3-(3-thiophenylmethyl)cyclohexane-1,3-diamine IUPAC Name: (1S,3S)-1-N-(6-fluoro-4-methylquinolin-2-yl)-3-N-(thiophen-3-ylmethyl)cyclohexane-1,3-diamine Traditional Name: (6-fluoro-4-methyl-2-quinolyl)-[(1S,3S)-3-(3-thenylamino)cyclohexyl]amine Formula: C21H24FN3S MolecularWeight: 369.498763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=C(C=C2)F)NC3CCCC(C3)NCC4=CSC=C4

Isomeric SMILES

CC1=CC(=NC2=C1C=C(C=C2)F)N[C@H]3CCC[C@@H](C3)NCC4=CSC=C4

InChI

InChI=1S/C21H24FN3S/c1-14-9-21(25-20-6-5-16(22)10-19(14)20)24-18-4-2-3-17(11-18)23-12-15-7-8-26-13-15/h5-10,13,17-18,23H,2-4,11-12H2,1H3,(H,24,25)/t17-,18-/m0/s1