3-(1,3-benzothiazol-2-yl)-N-[(4-piperidin-1-ylcarbonylphenyl)methyl]pyrazine-2-carboxamide

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-N-[(4-piperidin-1-ylcarbonylphenyl)methyl]pyrazine-2-carboxamide Openeye Name: 3-(1,3-benzothiazol-2-yl)-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]pyrazine-2-carboxamide CAS Name: 3-(1,3-benzothiazol-2-yl)-N-[[4-[oxo(1-piperidinyl)methyl]phenyl]methyl]-2-pyrazinecarboxamide IUPAC Name: 3-(1,3-benzothiazol-2-yl)-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]pyrazine-2-carboxamide Traditional Name: 3-(1,3-benzothiazol-2-yl)-N-[4-(piperidine-1-carbonyl)benzyl]pyrazinamide Formula: C25H23N5O2S MolecularWeight: 457.54742

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CC=C(C=C2)CNC(=O)C3=NC=CN=C3C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CC=C(C=C2)CNC(=O)C3=NC=CN=C3C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C25H23N5O2S/c31-23(21-22(27-13-12-26-21)24-29-19-6-2-3-7-20(19)33-24)28-16-17-8-10-18(11-9-17)25(32)30-14-4-1-5-15-30/h2-3,6-13H,1,4-5,14-16H2,(H,28,31)