[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-[3-(methylsulfanylmethyl)phenyl]methanone

Systemtic Name: [3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-[3-(methylsulfanylmethyl)phenyl]methanone Openeye Name: [3-(1,3-benzoxazol-2-yl)-1-piperidyl]-[3-(methylsulfanylmethyl)phenyl]methanone CAS Name: [3-(1,3-benzoxazol-2-yl)-1-piperidinyl]-[3-[(methylthio)methyl]phenyl]methanone IUPAC Name: [3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-[3-(methylsulfanylmethyl)phenyl]methanone Traditional Name: [3-(1,3-benzoxazol-2-yl)piperidino]-[3-[(methylthio)methyl]phenyl]methanone Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=CC=CC(=C1)C(=O)N2CCCC(C2)C3=NC4=CC=CC=C4O3

Isomeric SMILES

CSCC1=CC=CC(=C1)C(=O)N2CCCC(C2)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C21H22N2O2S/c1-26-14-15-6-4-7-16(12-15)21(24)23-11-5-8-17(13-23)20-22-18-9-2-3-10-19(18)25-20/h2-4,6-7,9-10,12,17H,5,8,11,13-14H2,1H3