(1S)-1-[4-cyclopentyl-5-[(2-phenylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]-3-methyl-butan-1-amine

Systemtic Name: (1S)-1-[4-cyclopentyl-5-[(2-phenylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]-3-methyl-butan-1-amine Openeye Name: (1S)-1-[4-cyclopentyl-5-[(2-phenylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]-3-methyl-butan-1-amine CAS Name: (1S)-1-[4-cyclopentyl-5-[(2-phenylphenyl)methylthio]-1,2,4-triazol-3-yl]-3-methyl-1-butanamine IUPAC Name: (1S)-1-[4-cyclopentyl-5-[(2-phenylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]-3-methylbutan-1-amine Traditional Name: [(1S)-1-[4-cyclopentyl-5-[(2-phenylbenzyl)thio]-1,2,4-triazol-3-yl]-3-methyl-butyl]amine Formula: C25H32N4S MolecularWeight: 420.61338

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=NN=C(N1C2CCCC2)SCC3=CC=CC=C3C4=CC=CC=C4)N

Isomeric SMILES

CC(C)C[C@@H](C1=NN=C(N1C2CCCC2)SCC3=CC=CC=C3C4=CC=CC=C4)N

InChI

InChI=1S/C25H32N4S/c1-18(2)16-23(26)24-27-28-25(29(24)21-13-7-8-14-21)30-17-20-12-6-9-15-22(20)19-10-4-3-5-11-19/h3-6,9-12,15,18,21,23H,7-8,13-14,16-17,26H2,1-2H3/t23-/m0/s1