3-(propan-2-ylcarbamoylamino)-N-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethyl]benzamide

Systemtic Name: 3-(propan-2-ylcarbamoylamino)-N-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethyl]benzamide Openeye Name: 3-(isopropylcarbamoylamino)-N-[2-[4-(2-pyridyl)piperazin-1-yl]sulfonylethyl]benzamide CAS Name: 3-[[oxo-(propan-2-ylamino)methyl]amino]-N-[2-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]ethyl]benzamide IUPAC Name: 3-(propan-2-ylcarbamoylamino)-N-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethyl]benzamide Traditional Name: 3-(isopropylcarbamoylamino)-N-[2-[4-(2-pyridyl)piperazino]sulfonylethyl]benzamide Formula: C22H30N6O4S MolecularWeight: 474.5764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC1=CC=CC(=C1)C(=O)NCCS(=O)(=O)N2CCN(CC2)C3=CC=CC=N3

Isomeric SMILES

CC(C)NC(=O)NC1=CC=CC(=C1)C(=O)NCCS(=O)(=O)N2CCN(CC2)C3=CC=CC=N3

InChI

InChI=1S/C22H30N6O4S/c1-17(2)25-22(30)26-19-7-5-6-18(16-19)21(29)24-10-15-33(31,32)28-13-11-27(12-14-28)20-8-3-4-9-23-20/h3-9,16-17H,10-15H2,1-2H3,(H,24,29)(H2,25,26,30)