1-methyl-4-[4-[(6-methyl-2,3-dihydro-1-benzothiophen-2-yl)carbonyl]piperazin-1-yl]sulfonyl-pyrrole-2-carboxamide

Systemtic Name: 1-methyl-4-[4-[(6-methyl-2,3-dihydro-1-benzothiophen-2-yl)carbonyl]piperazin-1-yl]sulfonyl-pyrrole-2-carboxamide Openeye Name: 1-methyl-4-[4-(6-methyl-2,3-dihydrobenzothiophene-2-carbonyl)piperazin-1-yl]sulfonyl-pyrrole-2-carboxamide CAS Name: 1-methyl-4-[[4-[(6-methyl-2,3-dihydro-1-benzothiophen-2-yl)-oxomethyl]-1-piperazinyl]sulfonyl]-2-pyrrolecarboxamide IUPAC Name: 1-methyl-4-[4-(6-methyl-2,3-dihydro-1-benzothiophene-2-carbonyl)piperazin-1-yl]sulfonylpyrrole-2-carboxamide Traditional Name: 1-methyl-4-[4-(6-methyl-2,3-dihydrobenzothiophene-2-carbonyl)piperazino]sulfonyl-pyrrole-2-carboxamide Formula: C20H24N4O4S2 MolecularWeight: 448.55896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(CC(S2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CN(C(=C4)C(=O)N)C)C=C1

Isomeric SMILES

CC1=CC2=C(CC(S2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CN(C(=C4)C(=O)N)C)C=C1

InChI

InChI=1S/C20H24N4O4S2/c1-13-3-4-14-10-18(29-17(14)9-13)20(26)23-5-7-24(8-6-23)30(27,28)15-11-16(19(21)25)22(2)12-15/h3-4,9,11-12,18H,5-8,10H2,1-2H3,(H2,21,25)