(1S,3S)-N3-(7-methoxy-4-methyl-quinolin-2-yl)-N1-[(1-methyl-5-phenylmethoxy-indol-3-yl)methyl]cyclopentane-1,3-diamine

Systemtic Name: (1S,3S)-N3-(7-methoxy-4-methyl-quinolin-2-yl)-N1-[(1-methyl-5-phenylmethoxy-indol-3-yl)methyl]cyclopentane-1,3-diamine Openeye Name: (1S,3S)-N1-[(5-benzyloxy-1-methyl-indol-3-yl)methyl]-N3-(7-methoxy-4-methyl-2-quinolyl)cyclopentane-1,3-diamine CAS Name: (1S,3S)-N3-(7-methoxy-4-methyl-2-quinolinyl)-N1-[(1-methyl-5-phenylmethoxy-3-indolyl)methyl]cyclopentane-1,3-diamine IUPAC Name: (1S,3S)-3-N-(7-methoxy-4-methylquinolin-2-yl)-1-N-[(1-methyl-5-phenylmethoxyindol-3-yl)methyl]cyclopentane-1,3-diamine Traditional Name: (5-benzoxy-1-methyl-indol-3-yl)methyl-[(1S,3S)-3-[(7-methoxy-4-methyl-2-quinolyl)amino]cyclopentyl]amine Formula: C33H36N4O2 MolecularWeight: 520.66454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=CC(=C2)OC)NC3CCC(C3)NCC4=CN(C5=C4C=C(C=C5)OCC6=CC=CC=C6)C

Isomeric SMILES

CC1=CC(=NC2=C1C=CC(=C2)OC)N[C@H]3CC[C@@H](C3)NCC4=CN(C5=C4C=C(C=C5)OCC6=CC=CC=C6)C

InChI

InChI=1S/C33H36N4O2/c1-22-15-33(36-31-18-27(38-3)11-13-29(22)31)35-26-10-9-25(16-26)34-19-24-20-37(2)32-14-12-28(17-30(24)32)39-21-23-7-5-4-6-8-23/h4-8,11-15,17-18,20,25-26,34H,9-10,16,19,21H2,1-3H3,(H,35,36)/t25-,26-/m0/s1