1-[(3S)-3-(5-ethylsulfanyl-4-methyl-1,2,4-triazol-3-yl)piperidin-1-yl]-2-(4-phenylphenyl)ethanone

Systemtic Name: 1-[(3S)-3-(5-ethylsulfanyl-4-methyl-1,2,4-triazol-3-yl)piperidin-1-yl]-2-(4-phenylphenyl)ethanone Openeye Name: 1-[(3S)-3-(5-ethylsulfanyl-4-methyl-1,2,4-triazol-3-yl)-1-piperidyl]-2-(4-phenylphenyl)ethanone CAS Name: 1-[(3S)-3-[5-(ethylthio)-4-methyl-1,2,4-triazol-3-yl]-1-piperidinyl]-2-(4-phenylphenyl)ethanone IUPAC Name: 1-[(3S)-3-(5-ethylsulfanyl-4-methyl-1,2,4-triazol-3-yl)piperidin-1-yl]-2-(4-phenylphenyl)ethanone Traditional Name: 1-[(3S)-3-[5-(ethylthio)-4-methyl-1,2,4-triazol-3-yl]piperidino]-2-(4-phenylphenyl)ethanone Formula: C24H28N4OS MolecularWeight: 420.57032

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(N1C)C2CCCN(C2)C(=O)CC3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CCSC1=NN=C(N1C)[C@H]2CCCN(C2)C(=O)CC3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H28N4OS/c1-3-30-24-26-25-23(27(24)2)21-10-7-15-28(17-21)22(29)16-18-11-13-20(14-12-18)19-8-5-4-6-9-19/h4-6,8-9,11-14,21H,3,7,10,15-17H2,1-2H3/t21-/m0/s1