1-methyl-4-[4-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]sulfonyl-pyrrole-2-carboxamide

Systemtic Name: 1-methyl-4-[4-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]sulfonyl-pyrrole-2-carboxamide Openeye Name: 1-methyl-4-[4-[[2-(3-thienyl)thiazol-4-yl]methyl]piperazin-1-yl]sulfonyl-pyrrole-2-carboxamide CAS Name: 1-methyl-4-[[4-[[2-(3-thiophenyl)-4-thiazolyl]methyl]-1-piperazinyl]sulfonyl]-2-pyrrolecarboxamide IUPAC Name: 1-methyl-4-[4-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]sulfonylpyrrole-2-carboxamide Traditional Name: 1-methyl-4-[4-[[2-(3-thienyl)thiazol-4-yl]methyl]piperazino]sulfonyl-pyrrole-2-carboxamide Formula: C18H21N5O3S3 MolecularWeight: 451.58604

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)CC3=CSC(=N3)C4=CSC=C4

Isomeric SMILES

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)CC3=CSC(=N3)C4=CSC=C4

InChI

InChI=1S/C18H21N5O3S3/c1-21-10-15(8-16(21)17(19)24)29(25,26)23-5-3-22(4-6-23)9-14-12-28-18(20-14)13-2-7-27-11-13/h2,7-8,10-12H,3-6,9H2,1H3,(H2,19,24)