4-[2-[[2-(1-benzothiophen-2-yl)phenyl]methylsulfinyl]ethanoyl]piperazine-1-carboxamide

Systemtic Name: 4-[2-[[2-(1-benzothiophen-2-yl)phenyl]methylsulfinyl]ethanoyl]piperazine-1-carboxamide Openeye Name: 4-[2-[[2-(benzothiophen-2-yl)phenyl]methylsulfinyl]acetyl]piperazine-1-carboxamide CAS Name: 4-[2-[[2-(1-benzothiophen-2-yl)phenyl]methylsulfinyl]-1-oxoethyl]-1-piperazinecarboxamide IUPAC Name: 4-[2-[[2-(1-benzothiophen-2-yl)phenyl]methylsulfinyl]acetyl]piperazine-1-carboxamide Traditional Name: 4-[2-[2-(benzothiophen-2-yl)benzyl]sulfinylacetyl]piperazine-1-carboxamide Formula: C22H23N3O3S2 MolecularWeight: 441.56632

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CS(=O)CC2=CC=CC=C2C3=CC4=CC=CC=C4S3)C(=O)N

Isomeric SMILES

C1CN(CCN1C(=O)CS(=O)CC2=CC=CC=C2C3=CC4=CC=CC=C4S3)C(=O)N

InChI

InChI=1S/C22H23N3O3S2/c23-22(27)25-11-9-24(10-12-25)21(26)15-30(28)14-17-6-1-3-7-18(17)20-13-16-5-2-4-8-19(16)29-20/h1-8,13H,9-12,14-15H2,(H2,23,27)