(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)-[4-(2-phenylsulfanylethyl)piperazin-1-yl]methanone

Systemtic Name: (5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)-[4-(2-phenylsulfanylethyl)piperazin-1-yl]methanone Openeye Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-[4-(2-phenylsulfanylethyl)piperazin-1-yl]methanone CAS Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-[4-[2-(phenylthio)ethyl]-1-piperazinyl]methanone IUPAC Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-[4-(2-phenylsulfanylethyl)piperazin-1-yl]methanone Traditional Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-[4-[2-(phenylthio)ethyl]piperazino]methanone Formula: C21H23ClN2O3S MolecularWeight: 418.93692

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCSC2=CC=CC=C2)C(=O)C3=CC4=C(C(=C3)Cl)OCCO4

Isomeric SMILES

C1CN(CCN1CCSC2=CC=CC=C2)C(=O)C3=CC4=C(C(=C3)Cl)OCCO4

InChI

InChI=1S/C21H23ClN2O3S/c22-18-14-16(15-19-20(18)27-12-11-26-19)21(25)24-8-6-23(7-9-24)10-13-28-17-4-2-1-3-5-17/h1-5,14-15H,6-13H2