N-(2-ethylhexyl)-2-methyl-1-(2-methylpropyl)-5-(2-pyrazin-2-yl-1,3-thiazol-4-yl)pyrrole-3-carboxamide

Systemtic Name: N-(2-ethylhexyl)-2-methyl-1-(2-methylpropyl)-5-(2-pyrazin-2-yl-1,3-thiazol-4-yl)pyrrole-3-carboxamide Openeye Name: N-(2-ethylhexyl)-1-isobutyl-2-methyl-5-(2-pyrazin-2-ylthiazol-4-yl)pyrrole-3-carboxamide CAS Name: N-(2-ethylhexyl)-2-methyl-1-(2-methylpropyl)-5-[2-(2-pyrazinyl)-4-thiazolyl]-3-pyrrolecarboxamide IUPAC Name: N-(2-ethylhexyl)-2-methyl-1-(2-methylpropyl)-5-(2-pyrazin-2-yl-1,3-thiazol-4-yl)pyrrole-3-carboxamide Traditional Name: N-(2-ethylhexyl)-1-isobutyl-2-methyl-5-(2-pyrazin-2-ylthiazol-4-yl)pyrrole-3-carboxamide Formula: C25H35N5OS MolecularWeight: 453.6433

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=O)C1=C(N(C(=C1)C2=CSC(=N2)C3=NC=CN=C3)CC(C)C)C

Isomeric SMILES

CCCCC(CC)CNC(=O)C1=C(N(C(=C1)C2=CSC(=N2)C3=NC=CN=C3)CC(C)C)C

InChI

InChI=1S/C25H35N5OS/c1-6-8-9-19(7-2)13-28-24(31)20-12-23(30(18(20)5)15-17(3)4)22-16-32-25(29-22)21-14-26-10-11-27-21/h10-12,14,16-17,19H,6-9,13,15H2,1-5H3,(H,28,31)