N-(3-methylphenyl)-4-(5-morpholin-4-ylsulfonylpyridin-2-yl)piperazine-1-carboxamide

Systemtic Name: N-(3-methylphenyl)-4-(5-morpholin-4-ylsulfonylpyridin-2-yl)piperazine-1-carboxamide Openeye Name: 4-(5-morpholinosulfonyl-2-pyridyl)-N-(m-tolyl)piperazine-1-carboxamide CAS Name: N-(3-methylphenyl)-4-[5-(4-morpholinylsulfonyl)-2-pyridinyl]-1-piperazinecarboxamide IUPAC Name: N-(3-methylphenyl)-4-(5-morpholin-4-ylsulfonylpyridin-2-yl)piperazine-1-carboxamide Traditional Name: 4-(5-morpholinosulfonyl-2-pyridyl)-N-(m-tolyl)piperazine-1-carboxamide Formula: C21H27N5O4S MolecularWeight: 445.53518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)N2CCN(CC2)C3=NC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)N2CCN(CC2)C3=NC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H27N5O4S/c1-17-3-2-4-18(15-17)23-21(27)25-9-7-24(8-10-25)20-6-5-19(16-22-20)31(28,29)26-11-13-30-14-12-26/h2-6,15-16H,7-14H2,1H3,(H,23,27)