3-chloranyl-N-[2-oxidanylidene-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[2-oxidanylidene-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[2-oxo-2-[4-(2-thienylsulfonyl)piperazin-1-yl]ethyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[2-oxo-2-(4-thiophen-2-ylsulfonyl-1-piperazinyl)ethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[2-oxo-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[2-keto-2-[4-(2-thienylsulfonyl)piperazino]ethyl]benzothiophene-2-carboxamide Formula: C19H18ClN3O4S3 MolecularWeight: 484.01192

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CNC(=O)C2=C(C3=CC=CC=C3S2)Cl)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C(=O)CNC(=O)C2=C(C3=CC=CC=C3S2)Cl)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C19H18ClN3O4S3/c20-17-13-4-1-2-5-14(13)29-18(17)19(25)21-12-15(24)22-7-9-23(10-8-22)30(26,27)16-6-3-11-28-16/h1-6,11H,7-10,12H2,(H,21,25)