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

Systemtic Name: 1-methyl-4-[4-[3-(thiophen-3-ylcarbonylamino)propanoyl]piperazin-1-yl]sulfonyl-pyrrole-2-carboxamide Openeye Name: 1-methyl-4-[4-[3-(thiophene-3-carbonylamino)propanoyl]piperazin-1-yl]sulfonyl-pyrrole-2-carboxamide CAS Name: 1-methyl-4-[[4-[1-oxo-3-[[oxo(3-thiophenyl)methyl]amino]propyl]-1-piperazinyl]sulfonyl]-2-pyrrolecarboxamide IUPAC Name: 1-methyl-4-[4-[3-(thiophene-3-carbonylamino)propanoyl]piperazin-1-yl]sulfonylpyrrole-2-carboxamide Traditional Name: 1-methyl-4-[4-[3-(3-thenoylamino)propanoyl]piperazino]sulfonyl-pyrrole-2-carboxamide Formula: C18H23N5O5S2 MolecularWeight: 453.53572

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)C(=O)CCNC(=O)C3=CSC=C3

Isomeric SMILES

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)C(=O)CCNC(=O)C3=CSC=C3

InChI

InChI=1S/C18H23N5O5S2/c1-21-11-14(10-15(21)17(19)25)30(27,28)23-7-5-22(6-8-23)16(24)2-4-20-18(26)13-3-9-29-12-13/h3,9-12H,2,4-8H2,1H3,(H2,19,25)(H,20,26)