2-(3-methylpiperazin-1-yl)-N-[(4-methylsulfonylphenyl)methyl]pyridine-3-carboxamide

Systemtic Name: 2-(3-methylpiperazin-1-yl)-N-[(4-methylsulfonylphenyl)methyl]pyridine-3-carboxamide Openeye Name: 2-(3-methylpiperazin-1-yl)-N-[(4-methylsulfonylphenyl)methyl]pyridine-3-carboxamide CAS Name: 2-(3-methyl-1-piperazinyl)-N-[(4-methylsulfonylphenyl)methyl]-3-pyridinecarboxamide IUPAC Name: 2-(3-methylpiperazin-1-yl)-N-[(4-methylsulfonylphenyl)methyl]pyridine-3-carboxamide Traditional Name: N-(4-mesylbenzyl)-2-(3-methylpiperazino)nicotinamide Formula: C19H24N4O3S MolecularWeight: 388.48386

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1)C2=C(C=CC=N2)C(=O)NCC3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC1CN(CCN1)C2=C(C=CC=N2)C(=O)NCC3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C19H24N4O3S/c1-14-13-23(11-10-20-14)18-17(4-3-9-21-18)19(24)22-12-15-5-7-16(8-6-15)27(2,25)26/h3-9,14,20H,10-13H2,1-2H3,(H,22,24)