[2-(1,3-benzoxazol-2-ylsulfanylmethyl)phenyl]-[4-(thiophen-3-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: [2-(1,3-benzoxazol-2-ylsulfanylmethyl)phenyl]-[4-(thiophen-3-ylmethyl)piperazin-1-yl]methanone Openeye Name: [2-(1,3-benzoxazol-2-ylsulfanylmethyl)phenyl]-[4-(3-thienylmethyl)piperazin-1-yl]methanone CAS Name: [2-[(1,3-benzoxazol-2-ylthio)methyl]phenyl]-[4-(3-thiophenylmethyl)-1-piperazinyl]methanone IUPAC Name: [2-(1,3-benzoxazol-2-ylsulfanylmethyl)phenyl]-[4-(thiophen-3-ylmethyl)piperazin-1-yl]methanone Traditional Name: [2-[(1,3-benzoxazol-2-ylthio)methyl]phenyl]-[4-(3-thenyl)piperazino]methanone Formula: C24H23N3O2S2 MolecularWeight: 449.58832

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CSC=C2)C(=O)C3=CC=CC=C3CSC4=NC5=CC=CC=C5O4

Isomeric SMILES

C1CN(CCN1CC2=CSC=C2)C(=O)C3=CC=CC=C3CSC4=NC5=CC=CC=C5O4

InChI

InChI=1S/C24H23N3O2S2/c28-23(27-12-10-26(11-13-27)15-18-9-14-30-16-18)20-6-2-1-5-19(20)17-31-24-25-21-7-3-4-8-22(21)29-24/h1-9,14,16H,10-13,15,17H2