4-(4-methylpiperazin-1-yl)sulfonyl-1-propan-2-yl-pyrrole-2-carboxylic acid

Systemtic Name: 4-(4-methylpiperazin-1-yl)sulfonyl-1-propan-2-yl-pyrrole-2-carboxylic acid Openeye Name: 1-isopropyl-4-(4-methylpiperazin-1-yl)sulfonyl-pyrrole-2-carboxylic acid CAS Name: 4-[(4-methyl-1-piperazinyl)sulfonyl]-1-propan-2-yl-2-pyrrolecarboxylic acid IUPAC Name: 4-(4-methylpiperazin-1-yl)sulfonyl-1-propan-2-ylpyrrole-2-carboxylic acid Traditional Name: 1-isopropyl-4-(4-methylpiperazino)sulfonyl-pyrrole-2-carboxylic acid Formula: C13H21N3O4S MolecularWeight: 315.38854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=C(C=C1C(=O)O)S(=O)(=O)N2CCN(CC2)C

Isomeric SMILES

CC(C)N1C=C(C=C1C(=O)O)S(=O)(=O)N2CCN(CC2)C

InChI

InChI=1S/C13H21N3O4S/c1-10(2)16-9-11(8-12(16)13(17)18)21(19,20)15-6-4-14(3)5-7-15/h8-10H,4-7H2,1-3H3,(H,17,18)