N-[[2-(4-ethylpiperazin-1-yl)-7-methoxy-quinolin-3-yl]methyl]-1-thiophen-2-yl-methanamine

Systemtic Name: N-[[2-(4-ethylpiperazin-1-yl)-7-methoxy-quinolin-3-yl]methyl]-1-thiophen-2-yl-methanamine Openeye Name: N-[[2-(4-ethylpiperazin-1-yl)-7-methoxy-3-quinolyl]methyl]-1-(2-thienyl)methanamine CAS Name: N-[[2-(4-ethyl-1-piperazinyl)-7-methoxy-3-quinolinyl]methyl]-1-thiophen-2-ylmethanamine IUPAC Name: N-[[2-(4-ethylpiperazin-1-yl)-7-methoxyquinolin-3-yl]methyl]-1-thiophen-2-ylmethanamine Traditional Name: [2-(4-ethylpiperazino)-7-methoxy-3-quinolyl]methyl-(2-thenyl)amine Formula: C22H28N4OS MolecularWeight: 396.54892

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C3C=CC(=CC3=N2)OC)CNCC4=CC=CS4

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C3C=CC(=CC3=N2)OC)CNCC4=CC=CS4

InChI

InChI=1S/C22H28N4OS/c1-3-25-8-10-26(11-9-25)22-18(15-23-16-20-5-4-12-28-20)13-17-6-7-19(27-2)14-21(17)24-22/h4-7,12-14,23H,3,8-11,15-16H2,1-2H3