N-(15-methylsulfonylpentadecyl)-6-(4-propylpiperazin-1-yl)pyridine-3-carboxamide

Systemtic Name: N-(15-methylsulfonylpentadecyl)-6-(4-propylpiperazin-1-yl)pyridine-3-carboxamide Openeye Name: N-(15-methylsulfonylpentadecyl)-6-(4-propylpiperazin-1-yl)pyridine-3-carboxamide CAS Name: N-(15-methylsulfonylpentadecyl)-6-(4-propyl-1-piperazinyl)-3-pyridinecarboxamide IUPAC Name: N-(15-methylsulfonylpentadecyl)-6-(4-propylpiperazin-1-yl)pyridine-3-carboxamide Traditional Name: N-(15-mesylpentadecyl)-6-(4-propylpiperazino)nicotinamide Formula: C29H52N4O3S MolecularWeight: 536.81318

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1)C2=NC=C(C=C2)C(=O)NCCCCCCCCCCCCCCCS(=O)(=O)C

Isomeric SMILES

CCCN1CCN(CC1)C2=NC=C(C=C2)C(=O)NCCCCCCCCCCCCCCCS(=O)(=O)C

InChI

InChI=1S/C29H52N4O3S/c1-3-20-32-21-23-33(24-22-32)28-18-17-27(26-31-28)29(34)30-19-15-13-11-9-7-5-4-6-8-10-12-14-16-25-37(2,35)36/h17-18,26H,3-16,19-25H2,1-2H3,(H,30,34)