(2-methylsulfanylphenyl)-[(3S)-1-(quinoxalin-5-ylmethyl)piperidin-3-yl]methanone

Systemtic Name: (2-methylsulfanylphenyl)-[(3S)-1-(quinoxalin-5-ylmethyl)piperidin-3-yl]methanone Openeye Name: (2-methylsulfanylphenyl)-[(3S)-1-(quinoxalin-5-ylmethyl)-3-piperidyl]methanone CAS Name: [2-(methylthio)phenyl]-[(3S)-1-(5-quinoxalinylmethyl)-3-piperidinyl]methanone IUPAC Name: (2-methylsulfanylphenyl)-[(3S)-1-(quinoxalin-5-ylmethyl)piperidin-3-yl]methanone Traditional Name: [2-(methylthio)phenyl]-[(3S)-1-(quinoxalin-5-ylmethyl)-3-piperidyl]methanone Formula: C22H23N3OS MolecularWeight: 377.50252

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)C2CCCN(C2)CC3=C4C(=CC=C3)N=CC=N4

Isomeric SMILES

CSC1=CC=CC=C1C(=O)[C@H]2CCCN(C2)CC3=C4C(=CC=C3)N=CC=N4

InChI

InChI=1S/C22H23N3OS/c1-27-20-10-3-2-8-18(20)22(26)17-7-5-13-25(15-17)14-16-6-4-9-19-21(16)24-12-11-23-19/h2-4,6,8-12,17H,5,7,13-15H2,1H3/t17-/m0/s1