N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-1-pyrazin-2-yl-piperidine-3-carboxamide

Systemtic Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-1-pyrazin-2-yl-piperidine-3-carboxamide Openeye Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-thiazol-2-yl]-1-pyrazin-2-yl-piperidine-3-carboxamide CAS Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-thiazolyl]-1-(2-pyrazinyl)-3-piperidinecarboxamide IUPAC Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-1-pyrazin-2-ylpiperidine-3-carboxamide Traditional Name: N-(4-methyl-5-piperonyl-thiazol-2-yl)-1-pyrazin-2-yl-nipecotamide Formula: C22H23N5O3S MolecularWeight: 437.51472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2CCCN(C2)C3=NC=CN=C3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2CCCN(C2)C3=NC=CN=C3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H23N5O3S/c1-14-19(10-15-4-5-17-18(9-15)30-13-29-17)31-22(25-14)26-21(28)16-3-2-8-27(12-16)20-11-23-6-7-24-20/h4-7,9,11,16H,2-3,8,10,12-13H2,1H3,(H,25,26,28)