N-(4-methylphenyl)sulfonyl-4-(pyridin-4-ylmethyl)piperazine-1-carboxamide

Systemtic Name: N-(4-methylphenyl)sulfonyl-4-(pyridin-4-ylmethyl)piperazine-1-carboxamide Openeye Name: N-(p-tolylsulfonyl)-4-(4-pyridylmethyl)piperazine-1-carboxamide CAS Name: N-(4-methylphenyl)sulfonyl-4-(pyridin-4-ylmethyl)-1-piperazinecarboxamide IUPAC Name: N-(4-methylphenyl)sulfonyl-4-(pyridin-4-ylmethyl)piperazine-1-carboxamide Traditional Name: 4-(4-pyridylmethyl)-N-tosyl-piperazine-1-carboxamide Formula: C18H22N4O3S MolecularWeight: 374.45728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)N2CCN(CC2)CC3=CC=NC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)N2CCN(CC2)CC3=CC=NC=C3

InChI

InChI=1S/C18H22N4O3S/c1-15-2-4-17(5-3-15)26(24,25)20-18(23)22-12-10-21(11-13-22)14-16-6-8-19-9-7-16/h2-9H,10-14H2,1H3,(H,20,23)