4-[4-[(3-chloranyl-1-benzothiophen-2-yl)carbonyl]piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide

Systemtic Name: 4-[4-[(3-chloranyl-1-benzothiophen-2-yl)carbonyl]piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide Openeye Name: 4-[4-(3-chlorobenzothiophene-2-carbonyl)piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide CAS Name: 4-[[4-[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]-1-piperazinyl]sulfonyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: 4-[4-(3-chloro-1-benzothiophene-2-carbonyl)piperazin-1-yl]sulfonyl-1-methylpyrrole-2-carboxamide Traditional Name: 4-[4-(3-chlorobenzothiophene-2-carbonyl)piperazino]sulfonyl-1-methyl-pyrrole-2-carboxamide Formula: C19H19ClN4O4S2 MolecularWeight: 466.96156

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C19H19ClN4O4S2/c1-22-11-12(10-14(22)18(21)25)30(27,28)24-8-6-23(7-9-24)19(26)17-16(20)13-4-2-3-5-15(13)29-17/h2-5,10-11H,6-9H2,1H3,(H2,21,25)