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

Systemtic Name: (1S)-1-[4-cyclopentyl-5-[(3-methoxyphenyl)methylsulfonyl]-1,2,4-triazol-3-yl]-3-methyl-butan-1-amine Openeye Name: (1S)-1-[4-cyclopentyl-5-[(3-methoxyphenyl)methylsulfonyl]-1,2,4-triazol-3-yl]-3-methyl-butan-1-amine CAS Name: (1S)-1-[4-cyclopentyl-5-[(3-methoxyphenyl)methylsulfonyl]-1,2,4-triazol-3-yl]-3-methyl-1-butanamine IUPAC Name: (1S)-1-[4-cyclopentyl-5-[(3-methoxyphenyl)methylsulfonyl]-1,2,4-triazol-3-yl]-3-methylbutan-1-amine Traditional Name: [(1S)-1-(4-cyclopentyl-5-m-anisylsulfonyl-1,2,4-triazol-3-yl)-3-methyl-butyl]amine Formula: C20H30N4O3S MolecularWeight: 406.5422

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=NN=C(N1C2CCCC2)S(=O)(=O)CC3=CC(=CC=C3)OC)N

Isomeric SMILES

CC(C)C[C@@H](C1=NN=C(N1C2CCCC2)S(=O)(=O)CC3=CC(=CC=C3)OC)N

InChI

InChI=1S/C20H30N4O3S/c1-14(2)11-18(21)19-22-23-20(24(19)16-8-4-5-9-16)28(25,26)13-15-7-6-10-17(12-15)27-3/h6-7,10,12,14,16,18H,4-5,8-9,11,13,21H2,1-3H3/t18-/m0/s1