(2S)-2-[[4-azanyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclohexyl-N-ethyl-propanamide

Systemtic Name: (2S)-2-[[4-azanyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclohexyl-N-ethyl-propanamide Openeye Name: (2S)-2-[[4-amino-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclohexyl-N-ethyl-propanamide CAS Name: (2S)-2-[[4-amino-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-N-cyclohexyl-N-ethylpropanamide IUPAC Name: (2S)-2-[[4-amino-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclohexyl-N-ethylpropanamide Traditional Name: (2S)-2-[[4-amino-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-N-cyclohexyl-N-ethyl-propionamide Formula: C20H29N5O2S MolecularWeight: 403.54156

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCCCC1)C(=O)C(C)SC2=NN=C(N2N)C3=CC=C(C=C3)OC

Isomeric SMILES

CCN(C1CCCCC1)C(=O)[C@H](C)SC2=NN=C(N2N)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H29N5O2S/c1-4-24(16-8-6-5-7-9-16)19(26)14(2)28-20-23-22-18(25(20)21)15-10-12-17(27-3)13-11-15/h10-14,16H,4-9,21H2,1-3H3/t14-/m0/s1