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

Systemtic Name: 3-azanyl-N-[(4-phenyl-1-propan-2-ylsulfonyl-piperidin-4-yl)methyl]pyrazine-2-carboxamide Openeye Name: 3-amino-N-[(1-isopropylsulfonyl-4-phenyl-4-piperidyl)methyl]pyrazine-2-carboxamide CAS Name: 3-amino-N-[(4-phenyl-1-propan-2-ylsulfonyl-4-piperidinyl)methyl]-2-pyrazinecarboxamide IUPAC Name: 3-amino-N-[(4-phenyl-1-propan-2-ylsulfonylpiperidin-4-yl)methyl]pyrazine-2-carboxamide Traditional Name: 3-amino-N-[(1-isopropylsulfonyl-4-phenyl-4-piperidyl)methyl]pyrazinamide Formula: C20H27N5O3S MolecularWeight: 417.52508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)N1CCC(CC1)(CNC(=O)C2=NC=CN=C2N)C3=CC=CC=C3

Isomeric SMILES

CC(C)S(=O)(=O)N1CCC(CC1)(CNC(=O)C2=NC=CN=C2N)C3=CC=CC=C3

InChI

InChI=1S/C20H27N5O3S/c1-15(2)29(27,28)25-12-8-20(9-13-25,16-6-4-3-5-7-16)14-24-19(26)17-18(21)23-11-10-22-17/h3-7,10-11,15H,8-9,12-14H2,1-2H3,(H2,21,23)(H,24,26)