5-[2-(3-methylsulfonylphenyl)pyridin-4-yl]-2-piperazin-1-yl-1H-pyrrole-3-carboxamide

Systemtic Name: 5-[2-(3-methylsulfonylphenyl)pyridin-4-yl]-2-piperazin-1-yl-1H-pyrrole-3-carboxamide Openeye Name: 5-[2-(3-methylsulfonylphenyl)-4-pyridyl]-2-piperazin-1-yl-1H-pyrrole-3-carboxamide CAS Name: 5-[2-(3-methylsulfonylphenyl)-4-pyridinyl]-2-(1-piperazinyl)-1H-pyrrole-3-carboxamide IUPAC Name: 5-[2-(3-methylsulfonylphenyl)pyridin-4-yl]-2-piperazin-1-yl-1H-pyrrole-3-carboxamide Traditional Name: 5-[2-(3-mesylphenyl)-4-pyridyl]-2-piperazino-1H-pyrrole-3-carboxamide Formula: C21H23N5O3S MolecularWeight: 425.50402

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C2=NC=CC(=C2)C3=CC(=C(N3)N4CCNCC4)C(=O)N

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C2=NC=CC(=C2)C3=CC(=C(N3)N4CCNCC4)C(=O)N

InChI

InChI=1S/C21H23N5O3S/c1-30(28,29)16-4-2-3-14(11-16)18-12-15(5-6-24-18)19-13-17(20(22)27)21(25-19)26-9-7-23-8-10-26/h2-6,11-13,23,25H,7-10H2,1H3,(H2,22,27)