N-[[4-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-yl]carbonylphenyl]methyl]thiophene-2-carboxamide

Systemtic Name: N-[[4-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-yl]carbonylphenyl]methyl]thiophene-2-carboxamide Openeye Name: N-[[4-[4-[(5-chloro-2-thienyl)methyl]piperazine-1-carbonyl]phenyl]methyl]thiophene-2-carboxamide CAS Name: N-[[4-[[4-[(5-chloro-2-thiophenyl)methyl]-1-piperazinyl]-oxomethyl]phenyl]methyl]-2-thiophenecarboxamide IUPAC Name: N-[[4-[4-[(5-chlorothiophen-2-yl)methyl]piperazine-1-carbonyl]phenyl]methyl]thiophene-2-carboxamide Traditional Name: N-[4-[4-[(5-chloro-2-thienyl)methyl]piperazine-1-carbonyl]benzyl]thiophene-2-carboxamide Formula: C22H22ClN3O2S2 MolecularWeight: 460.01198

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(S2)Cl)C(=O)C3=CC=C(C=C3)CNC(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1CC2=CC=C(S2)Cl)C(=O)C3=CC=C(C=C3)CNC(=O)C4=CC=CS4

InChI

InChI=1S/C22H22ClN3O2S2/c23-20-8-7-18(30-20)15-25-9-11-26(12-10-25)22(28)17-5-3-16(4-6-17)14-24-21(27)19-2-1-13-29-19/h1-8,13H,9-12,14-15H2,(H,24,27)