3-azanyl-N-[(4-phenyl-1-propan-2-ylsulfonyl-piperidin-4-yl)methyl]pyridine-2-carboxamide

Systemtic Name: 3-azanyl-N-[(4-phenyl-1-propan-2-ylsulfonyl-piperidin-4-yl)methyl]pyridine-2-carboxamide Openeye Name: 3-amino-N-[(1-isopropylsulfonyl-4-phenyl-4-piperidyl)methyl]pyridine-2-carboxamide CAS Name: 3-amino-N-[(4-phenyl-1-propan-2-ylsulfonyl-4-piperidinyl)methyl]-2-pyridinecarboxamide IUPAC Name: 3-amino-N-[(4-phenyl-1-propan-2-ylsulfonylpiperidin-4-yl)methyl]pyridine-2-carboxamide Traditional Name: 3-amino-N-[(1-isopropylsulfonyl-4-phenyl-4-piperidyl)methyl]picolinamide Formula: C21H28N4O3S MolecularWeight: 416.53702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)N1CCC(CC1)(CNC(=O)C2=C(C=CC=N2)N)C3=CC=CC=C3

Isomeric SMILES

CC(C)S(=O)(=O)N1CCC(CC1)(CNC(=O)C2=C(C=CC=N2)N)C3=CC=CC=C3

InChI

InChI=1S/C21H28N4O3S/c1-16(2)29(27,28)25-13-10-21(11-14-25,17-7-4-3-5-8-17)15-24-20(26)19-18(22)9-6-12-23-19/h3-9,12,16H,10-11,13-15,22H2,1-2H3,(H,24,26)