4-[(6-chloranyl-1-benzothiophen-2-yl)sulfonyl]-1-[[4-(C-piperidin-1-ylcarbonimidoyl)phenyl]methyl]piperazin-2-one

Systemtic Name: 4-[(6-chloranyl-1-benzothiophen-2-yl)sulfonyl]-1-[[4-(C-piperidin-1-ylcarbonimidoyl)phenyl]methyl]piperazin-2-one Openeye Name: 4-(6-chlorobenzothiophen-2-yl)sulfonyl-1-[[4-(piperidine-1-carboximidoyl)phenyl]methyl]piperazin-2-one CAS Name: 4-[(6-chloro-1-benzothiophen-2-yl)sulfonyl]-1-[[4-[imino(1-piperidinyl)methyl]phenyl]methyl]-2-piperazinone IUPAC Name: 4-[(6-chloro-1-benzothiophen-2-yl)sulfonyl]-1-[[4-(piperidine-1-carboximidoyl)phenyl]methyl]piperazin-2-one Traditional Name: 4-(6-chlorobenzothiophen-2-yl)sulfonyl-1-[4-(piperidine-1-carboximidoyl)benzyl]piperazin-2-one Formula: C25H27ClN4O3S2 MolecularWeight: 531.08988

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=N)C2=CC=C(C=C2)CN3CCN(CC3=O)S(=O)(=O)C4=CC5=C(S4)C=C(C=C5)Cl

Isomeric SMILES

C1CCN(CC1)C(=N)C2=CC=C(C=C2)CN3CCN(CC3=O)S(=O)(=O)C4=CC5=C(S4)C=C(C=C5)Cl

InChI

InChI=1S/C25H27ClN4O3S2/c26-21-9-8-20-14-24(34-22(20)15-21)35(32,33)30-13-12-29(23(31)17-30)16-18-4-6-19(7-5-18)25(27)28-10-2-1-3-11-28/h4-9,14-15,27H,1-3,10-13,16-17H2