3-[4-(4-methoxyphenyl)piperazin-1-yl]-1,1-bis(oxidanylidene)-1-benzothiophene-2-carboxamide

Systemtic Name: 3-[4-(4-methoxyphenyl)piperazin-1-yl]-1,1-bis(oxidanylidene)-1-benzothiophene-2-carboxamide Openeye Name: 3-[4-(4-methoxyphenyl)piperazin-1-yl]-1,1-dioxo-benzothiophene-2-carboxamide CAS Name: 3-[4-(4-methoxyphenyl)-1-piperazinyl]-1,1-dioxo-1-benzothiophene-2-carboxamide IUPAC Name: 3-[4-(4-methoxyphenyl)piperazin-1-yl]-1,1-dioxo-1-benzothiophene-2-carboxamide Traditional Name: 1,1-diketo-3-[4-(4-methoxyphenyl)piperazino]benzothiophene-2-carboxamide Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C3=C(S(=O)(=O)C4=CC=CC=C43)C(=O)N

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C3=C(S(=O)(=O)C4=CC=CC=C43)C(=O)N

InChI

InChI=1S/C20H21N3O4S/c1-27-15-8-6-14(7-9-15)22-10-12-23(13-11-22)18-16-4-2-3-5-17(16)28(25,26)19(18)20(21)24/h2-9H,10-13H2,1H3,(H2,21,24)